system_id stringlengths 17 57 | split stringclasses 1
value | entry_pdb_id stringlengths 4 4 | entry_determination_method stringclasses 8
values | entry_resolution float32 0.64 37 ⌀ | is_experimental bool 1
class | protein_sequence stringlengths 2 5.16k | protein_chain_id stringclasses 455
values | protein_instance_chain stringlengths 3 5 | ligand_smiles stringlengths 2 604 | ligand_ccd_code stringlengths 1 135 | ligand_instance_chain stringlengths 3 5 | ligand_is_proper bool 2
classes | ligand_is_covalent bool 2
classes | ligand_molecular_weight float32 7.02 3.45k | system_pass_validation_criteria bool 2
classes | system_num_protein_chains int32 1 5 | system_num_ligand_chains int32 1 5 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
1cwp__1__17.F_28.E_28.F__28.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 17.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 28.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__18.E_18.F_52.F__18.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 18.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 18.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__17.E_17.F_28.F__17.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 17.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 17.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__17.E_18.D_18.F__18.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 17.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 18.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__18.D_18.E_19.D__18.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 18.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 18.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__18.F_52.E_52.F__52.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 18.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 52.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__19.D_19.E_20.D__19.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 19.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 19.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__18.E_19.D_19.F__19.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 18.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 19.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__21.D_21.F_25.E__21.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 21.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 21.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__20.F_39.E_39.F__39.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 20.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 39.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__21.E_21.F_26.F__21.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 21.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 21.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__2.E_3.D_3.F__3.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 2.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 3.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__20.E_20.F_39.F__20.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 20.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 20.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__2.F_23.E_23.F__23.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 2.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 23.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__19.E_20.D_20.F__20.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 19.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 20.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__19.E_19.F_60.F__19.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 19.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 19.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__21.D_21.E_22.D__21.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 21.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 21.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__21.D_25.D_25.E__25.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 21.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 25.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__21.E_22.D_22.F__22.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 21.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 22.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__2.D_2.E_3.D__2.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 2.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 2.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__22.D_22.E_23.D__22.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 22.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 22.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__19.F_60.E_60.F__60.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 19.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 60.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__23.D_23.E_24.D__23.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 23.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 23.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__23.E_24.D_24.F__24.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 23.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 24.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__22.E_23.D_23.F__23.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 22.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 23.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__21.F_26.E_26.F__26.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 21.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 26.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__26.D_26.F_30.E__26.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 26.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 26.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__22.E_22.F_43.F__22.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 22.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 22.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__24.E_25.D_25.F__25.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 24.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 25.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__25.E_25.F_54.F__25.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 25.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 25.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__26.D_26.E_27.D__26.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 26.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 26.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__26.D_30.D_30.E__30.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 26.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 30.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__24.D_24.E_25.D__24.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 24.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 24.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__22.F_43.E_43.F__43.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 22.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 43.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__27.D_27.E_28.D__27.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 27.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 27.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__27.E_28.D_28.F__28.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 27.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 28.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__26.E_27.D_27.F__27.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 26.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 27.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__27.F_53.E_53.F__53.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 27.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 53.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__27.E_27.F_53.F__27.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 27.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 27.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__2.E_2.F_23.F__2.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 2.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 2.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__25.F_54.E_54.F__54.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 25.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 54.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__29.D_29.E_30.D__29.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 29.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 29.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__3.D_3.E_4.D__3.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 3.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 3.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__29.E_30.D_30.F__30.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 29.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 30.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__28.D_28.E_29.D__28.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 28.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 28.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__3.E_4.D_4.F__4.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 3.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 4.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__28.E_29.D_29.F__29.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 28.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 29.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__3.F_42.E_42.F__42.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 3.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 42.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__3.E_3.F_42.F__3.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 3.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 3.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__30.F_44.E_44.F__44.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 30.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 44.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__30.E_30.F_44.F__30.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 30.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 30.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__32.E_32.F_58.F__32.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 32.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 32.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__31.F_36.E_36.F__36.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 31.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 36.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__32.D_32.E_33.D__32.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 32.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 32.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__31.D_31.F_35.E__31.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 31.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 31.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__31.D_31.E_32.D__31.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 31.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 31.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__31.D_35.D_35.E__35.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 31.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 35.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__31.E_32.D_32.F__32.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 31.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 32.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__31.E_31.F_36.F__31.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 31.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 31.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__33.E_33.F_7.F__33.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 33.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 33.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__32.E_33.D_33.F__33.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 32.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 33.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__33.F_7.E_7.F__7.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 33.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 7.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__32.F_58.E_58.F__58.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 32.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 58.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__33.E_34.D_34.F__34.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 33.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 34.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__35.E_35.F_49.F__35.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 35.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 35.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__33.D_33.E_34.D__33.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 33.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 33.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__36.D_36.E_37.D__36.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 36.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 36.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__34.D_34.E_35.D__34.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 34.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 34.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__34.F_5.E_5.F__5.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 34.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 5.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__34.E_34.F_5.F__34.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 34.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 34.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__35.F_49.E_49.F__49.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 35.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 49.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__36.D_36.F_40.E__36.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 36.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 36.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__36.E_37.D_37.F__37.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 36.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 37.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__37.E_38.D_38.F__38.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 37.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 38.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__36.D_40.D_40.E__40.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 36.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 40.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__37.D_37.E_38.D__37.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 37.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 37.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__38.D_38.E_39.D__38.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 38.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 38.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__37.F_48.E_48.F__48.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 37.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 48.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__4.F_50.E_50.F__50.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 4.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 50.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__39.D_39.E_40.D__39.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 39.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 39.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__38.E_39.D_39.F__39.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 38.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 39.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__4.E_4.F_50.F__4.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 4.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 4.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__41.D_41.E_42.D__41.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 41.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 41.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__40.E_40.F_59.F__40.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 40.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 40.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__42.E_43.D_43.F__43.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 42.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 43.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__39.E_40.D_40.F__40.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 39.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 40.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__41.E_42.D_42.F__42.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 41.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 42.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__41.D_45.D_45.E__45.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 41.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 45.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__34.E_35.D_35.F__35.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 34.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@](=O)(O)O2)[C@@H](CO[P@@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 35.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__40.F_59.E_59.F__59.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 40.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 59.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__41.D_41.F_45.E__41.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 41.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 41.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__41.E_41.F_46.F__41.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 41.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 41.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__4.D_4.E_5.D__4.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 4.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 4.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__41.F_46.E_46.F__46.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | F | 41.F | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 46.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__4.E_5.D_5.F__5.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 4.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 5.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__43.E_44.D_44.F__44.C | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 43.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@@H]2O[C@@H]3[C@H](O[P@@](=O)(O)O2)[C@@H](CO[P@](=O)(O)O[C@H]2[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]2COP(=O)=O)O[C@H]3n2ccc(=O)[nH]c2=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U-A-U | 44.C | true | false | 1,268.140015 | false | 3 | 1 |
1cwp__1__42.D_42.E_43.D__42.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 42.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 42.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__37.E_37.F_48.F__37.B | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | E | 37.E | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)=O)[C@@H](O[P@@](=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O | A-U | 37.B | true | false | 635.07782 | false | 3 | 1 |
1cwp__1__43.D_43.E_44.D__43.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 43.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 43.A | true | false | 1,270.15564 | false | 3 | 1 |
1cwp__1__44.D_44.E_45.D__44.A | train | 1cwp | X-RAY DIFFRACTION | 3.2 | true | MSTVGTGKLTRAQRRAAARKNKRNTRVVQPVIVEPIASGQGKAIKAWTGYSVSKWTASCAAAEAKVTSAITISLPNELSSERNKQLKVGRVLLWLGLLPSVSGTVKSCVTETQTTAAASFQVALAVADNSKDVVAAMYPEAFKGITLEQLAADLTIYLYSSAALTEGDVIVHLEVEHVRPTFDDSFTPVY | D | 44.D | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COO[C@@H]2C[C@@H](CO[P@@](=O)(O)O[C@H]3[C@@H](O)[C@H](n4cnc5c(N)ncnc54)O[C@@H]3COP(=O)=O)O[C@H]2n2ccc(=O)[nH]c2=O)[C@@H](OOP(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O.Op1oo1 | A-U-A-U | 44.A | true | false | 1,270.15564 | false | 3 | 1 |
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