complex_id stringlengths 6 8 | ligand_pdbqt_path stringlengths 34 38 | target_pdbqt_path stringlengths 34 38 | decoys_pdbqt_path stringlengths 34 38 ⌀ | decoy_scores_csv_path stringlengths 38 42 ⌀ |
|---|---|---|---|---|
5EVB-3R9 | data/5E/5EVB-3R9/5EVB-3R9_ligand.pdbqt | data/5E/5EVB-3R9/5EVB-3R9_target.pdbqt | data/5E/5EVB-3R9/5EVB-3R9_decoys.pdbqt | data/5E/5EVB-3R9/5EVB-3R9_decoy_scores.csv |
5E5U-1PS | data/5E/5E5U-1PS/5E5U-1PS_ligand.pdbqt | data/5E/5E5U-1PS/5E5U-1PS_target.pdbqt | data/5E/5E5U-1PS/5E5U-1PS_decoys.pdbqt | data/5E/5E5U-1PS/5E5U-1PS_decoy_scores.csv |
5EC2-F09 | data/5E/5EC2-F09/5EC2-F09_ligand.pdbqt | data/5E/5EC2-F09/5EC2-F09_target.pdbqt | data/5E/5EC2-F09/5EC2-F09_decoys.pdbqt | data/5E/5EC2-F09/5EC2-F09_decoy_scores.csv |
5EPR-5QY | data/5E/5EPR-5QY/5EPR-5QY_ligand.pdbqt | data/5E/5EPR-5QY/5EPR-5QY_target.pdbqt | data/5E/5EPR-5QY/5EPR-5QY_decoys.pdbqt | data/5E/5EPR-5QY/5EPR-5QY_decoy_scores.csv |
5EZX-5T5 | data/5E/5EZX-5T5/5EZX-5T5_ligand.pdbqt | data/5E/5EZX-5T5/5EZX-5T5_target.pdbqt | data/5E/5EZX-5T5/5EZX-5T5_decoys.pdbqt | data/5E/5EZX-5T5/5EZX-5T5_decoy_scores.csv |
5EGS-SAH | data/5E/5EGS-SAH/5EGS-SAH_ligand.pdbqt | data/5E/5EGS-SAH/5EGS-SAH_target.pdbqt | data/5E/5EGS-SAH/5EGS-SAH_decoys.pdbqt | data/5E/5EGS-SAH/5EGS-SAH_decoy_scores.csv |
5EZG-5T4 | data/5E/5EZG-5T4/5EZG-5T4_ligand.pdbqt | data/5E/5EZG-5T4/5EZG-5T4_target.pdbqt | data/5E/5EZG-5T4/5EZG-5T4_decoys.pdbqt | data/5E/5EZG-5T4/5EZG-5T4_decoy_scores.csv |
5E3G-5JQ | data/5E/5E3G-5JQ/5E3G-5JQ_ligand.pdbqt | data/5E/5E3G-5JQ/5E3G-5JQ_target.pdbqt | data/5E/5E3G-5JQ/5E3G-5JQ_decoys.pdbqt | data/5E/5E3G-5JQ/5E3G-5JQ_decoy_scores.csv |
5E7R-5KW | data/5E/5E7R-5KW/5E7R-5KW_ligand.pdbqt | data/5E/5E7R-5KW/5E7R-5KW_target.pdbqt | data/5E/5E7R-5KW/5E7R-5KW_decoys.pdbqt | data/5E/5E7R-5KW/5E7R-5KW_decoy_scores.csv |
5E0R-5J5 | data/5E/5E0R-5J5/5E0R-5J5_ligand.pdbqt | data/5E/5E0R-5J5/5E0R-5J5_target.pdbqt | data/5E/5E0R-5J5/5E0R-5J5_decoys.pdbqt | data/5E/5E0R-5J5/5E0R-5J5_decoy_scores.csv |
5EDI-5M9 | data/5E/5EDI-5M9/5EDI-5M9_ligand.pdbqt | data/5E/5EDI-5M9/5EDI-5M9_target.pdbqt | data/5E/5EDI-5M9/5EDI-5M9_decoys.pdbqt | data/5E/5EDI-5M9/5EDI-5M9_decoy_scores.csv |
5E2A-SAH | data/5E/5E2A-SAH/5E2A-SAH_ligand.pdbqt | data/5E/5E2A-SAH/5E2A-SAH_target.pdbqt | data/5E/5E2A-SAH/5E2A-SAH_decoys.pdbqt | data/5E/5E2A-SAH/5E2A-SAH_decoy_scores.csv |
5EWY-5TQ | data/5E/5EWY-5TQ/5EWY-5TQ_ligand.pdbqt | data/5E/5EWY-5TQ/5EWY-5TQ_target.pdbqt | data/5E/5EWY-5TQ/5EWY-5TQ_decoys.pdbqt | data/5E/5EWY-5TQ/5EWY-5TQ_decoy_scores.csv |
5EZ5-GTP | data/5E/5EZ5-GTP/5EZ5-GTP_ligand.pdbqt | data/5E/5EZ5-GTP/5EZ5-GTP_target.pdbqt | data/5E/5EZ5-GTP/5EZ5-GTP_decoys.pdbqt | data/5E/5EZ5-GTP/5EZ5-GTP_decoy_scores.csv |
5EYC-5SZ | data/5E/5EYC-5SZ/5EYC-5SZ_ligand.pdbqt | data/5E/5EYC-5SZ/5EYC-5SZ_target.pdbqt | data/5E/5EYC-5SZ/5EYC-5SZ_decoys.pdbqt | data/5E/5EYC-5SZ/5EYC-5SZ_decoy_scores.csv |
5EXM-5ST | data/5E/5EXM-5ST/5EXM-5ST_ligand.pdbqt | data/5E/5EXM-5ST/5EXM-5ST_target.pdbqt | data/5E/5EXM-5ST/5EXM-5ST_decoys.pdbqt | data/5E/5EXM-5ST/5EXM-5ST_decoy_scores.csv |
5E0H-5LH | data/5E/5E0H-5LH/5E0H-5LH_ligand.pdbqt | data/5E/5E0H-5LH/5E0H-5LH_target.pdbqt | data/5E/5E0H-5LH/5E0H-5LH_decoys.pdbqt | data/5E/5E0H-5LH/5E0H-5LH_decoy_scores.csv |
5ECV-5M2 | data/5E/5ECV-5M2/5ECV-5M2_ligand.pdbqt | data/5E/5ECV-5M2/5ECV-5M2_target.pdbqt | data/5E/5ECV-5M2/5ECV-5M2_decoys.pdbqt | data/5E/5ECV-5M2/5ECV-5M2_decoy_scores.csv |
5EHS-2JJ | data/5E/5EHS-2JJ/5EHS-2JJ_ligand.pdbqt | data/5E/5EHS-2JJ/5EHS-2JJ_target.pdbqt | data/5E/5EHS-2JJ/5EHS-2JJ_decoys.pdbqt | data/5E/5EHS-2JJ/5EHS-2JJ_decoy_scores.csv |
5ETS-5RX | data/5E/5ETS-5RX/5ETS-5RX_ligand.pdbqt | data/5E/5ETS-5RX/5ETS-5RX_target.pdbqt | data/5E/5ETS-5RX/5ETS-5RX_decoys.pdbqt | data/5E/5ETS-5RX/5ETS-5RX_decoy_scores.csv |
5E9Z-PP9 | data/5E/5E9Z-PP9/5E9Z-PP9_ligand.pdbqt | data/5E/5E9Z-PP9/5E9Z-PP9_target.pdbqt | data/5E/5E9Z-PP9/5E9Z-PP9_decoys.pdbqt | data/5E/5E9Z-PP9/5E9Z-PP9_decoy_scores.csv |
5EA9-FMN | data/5E/5EA9-FMN/5EA9-FMN_ligand.pdbqt | data/5E/5EA9-FMN/5EA9-FMN_target.pdbqt | data/5E/5EA9-FMN/5EA9-FMN_decoys.pdbqt | data/5E/5EA9-FMN/5EA9-FMN_decoy_scores.csv |
5ELV-5PX | data/5E/5ELV-5PX/5ELV-5PX_ligand.pdbqt | data/5E/5ELV-5PX/5ELV-5PX_target.pdbqt | data/5E/5ELV-5PX/5ELV-5PX_decoys.pdbqt | data/5E/5ELV-5PX/5ELV-5PX_decoy_scores.csv |
5ESJ-TPF | data/5E/5ESJ-TPF/5ESJ-TPF_ligand.pdbqt | data/5E/5ESJ-TPF/5ESJ-TPF_target.pdbqt | data/5E/5ESJ-TPF/5ESJ-TPF_decoys.pdbqt | data/5E/5ESJ-TPF/5ESJ-TPF_decoy_scores.csv |
5ER9-UDP | data/5E/5ER9-UDP/5ER9-UDP_ligand.pdbqt | data/5E/5ER9-UDP/5ER9-UDP_target.pdbqt | data/5E/5ER9-UDP/5ER9-UDP_decoys.pdbqt | data/5E/5ER9-UDP/5ER9-UDP_decoy_scores.csv |
5E8X-STU | data/5E/5E8X-STU/5E8X-STU_ligand.pdbqt | data/5E/5E8X-STU/5E8X-STU_target.pdbqt | data/5E/5E8X-STU/5E8X-STU_decoys.pdbqt | data/5E/5E8X-STU/5E8X-STU_decoy_scores.csv |
5EHG-SAM | data/5E/5EHG-SAM/5EHG-SAM_ligand.pdbqt | data/5E/5EHG-SAM/5EHG-SAM_target.pdbqt | data/5E/5EHG-SAM/5EHG-SAM_decoys.pdbqt | data/5E/5EHG-SAM/5EHG-SAM_decoy_scores.csv |
5E7Z-TRP | data/5E/5E7Z-TRP/5E7Z-TRP_ligand.pdbqt | data/5E/5E7Z-TRP/5E7Z-TRP_target.pdbqt | data/5E/5E7Z-TRP/5E7Z-TRP_decoys.pdbqt | data/5E/5E7Z-TRP/5E7Z-TRP_decoy_scores.csv |
5EHM-OEM | data/5E/5EHM-OEM/5EHM-OEM_ligand.pdbqt | data/5E/5EHM-OEM/5EHM-OEM_target.pdbqt | data/5E/5EHM-OEM/5EHM-OEM_decoys.pdbqt | data/5E/5EHM-OEM/5EHM-OEM_decoy_scores.csv |
5EVZ-ADP | data/5E/5EVZ-ADP/5EVZ-ADP_ligand.pdbqt | data/5E/5EVZ-ADP/5EVZ-ADP_target.pdbqt | data/5E/5EVZ-ADP/5EVZ-ADP_decoys.pdbqt | data/5E/5EVZ-ADP/5EVZ-ADP_decoy_scores.csv |
5E93-FMN | data/5E/5E93-FMN/5E93-FMN_ligand.pdbqt | data/5E/5E93-FMN/5E93-FMN_target.pdbqt | data/5E/5E93-FMN/5E93-FMN_decoys.pdbqt | data/5E/5E93-FMN/5E93-FMN_decoy_scores.csv |
5EV9-5SB | data/5E/5EV9-5SB/5EV9-5SB_ligand.pdbqt | data/5E/5EV9-5SB/5EV9-5SB_target.pdbqt | data/5E/5EV9-5SB/5EV9-5SB_decoys.pdbqt | data/5E/5EV9-5SB/5EV9-5SB_decoy_scores.csv |
5EW3-5T2 | data/5E/5EW3-5T2/5EW3-5T2_ligand.pdbqt | data/5E/5EW3-5T2/5EW3-5T2_target.pdbqt | data/5E/5EW3-5T2/5EW3-5T2_decoys.pdbqt | data/5E/5EW3-5T2/5EW3-5T2_decoy_scores.csv |
5E19-5K7 | data/5E/5E19-5K7/5E19-5K7_ligand.pdbqt | data/5E/5E19-5K7/5E19-5K7_target.pdbqt | data/5E/5E19-5K7/5E19-5K7_decoys.pdbqt | data/5E/5E19-5K7/5E19-5K7_decoy_scores.csv |
5E5G-DTR | data/5E/5E5G-DTR/5E5G-DTR_ligand.pdbqt | data/5E/5E5G-DTR/5E5G-DTR_target.pdbqt | data/5E/5E5G-DTR/5E5G-DTR_decoys.pdbqt | data/5E/5E5G-DTR/5E5G-DTR_decoy_scores.csv |
5EAG-5LU | data/5E/5EAG-5LU/5EAG-5LU_ligand.pdbqt | data/5E/5EAG-5LU/5EAG-5LU_target.pdbqt | data/5E/5EAG-5LU/5EAG-5LU_decoys.pdbqt | data/5E/5EAG-5LU/5EAG-5LU_decoy_scores.csv |
5EZR-4ZS | data/5E/5EZR-4ZS/5EZR-4ZS_ligand.pdbqt | data/5E/5EZR-4ZS/5EZR-4ZS_target.pdbqt | data/5E/5EZR-4ZS/5EZR-4ZS_decoys.pdbqt | data/5E/5EZR-4ZS/5EZR-4ZS_decoy_scores.csv |
5E74-5KH | data/5E/5E74-5KH/5E74-5KH_ligand.pdbqt | data/5E/5E74-5KH/5E74-5KH_target.pdbqt | data/5E/5E74-5KH/5E74-5KH_decoys.pdbqt | data/5E/5E74-5KH/5E74-5KH_decoy_scores.csv |
5ECE-5N2 | data/5E/5ECE-5N2/5ECE-5N2_ligand.pdbqt | data/5E/5ECE-5N2/5ECE-5N2_target.pdbqt | data/5E/5ECE-5N2/5ECE-5N2_decoys.pdbqt | data/5E/5ECE-5N2/5ECE-5N2_decoy_scores.csv |
5E8J-SAH | data/5E/5E8J-SAH/5E8J-SAH_ligand.pdbqt | data/5E/5E8J-SAH/5E8J-SAH_target.pdbqt | data/5E/5E8J-SAH/5E8J-SAH_decoys.pdbqt | data/5E/5E8J-SAH/5E8J-SAH_decoy_scores.csv |
5EE5-GTP | data/5E/5EE5-GTP/5EE5-GTP_ligand.pdbqt | data/5E/5EE5-GTP/5EE5-GTP_target.pdbqt | data/5E/5EE5-GTP/5EE5-GTP_decoys.pdbqt | data/5E/5EE5-GTP/5EE5-GTP_decoy_scores.csv |
5E8Q-FOL | data/5E/5E8Q-FOL/5E8Q-FOL_ligand.pdbqt | data/5E/5E8Q-FOL/5E8Q-FOL_target.pdbqt | data/5E/5E8Q-FOL/5E8Q-FOL_decoys.pdbqt | data/5E/5E8Q-FOL/5E8Q-FOL_decoy_scores.csv |
5EHW-5OO | data/5E/5EHW-5OO/5EHW-5OO_ligand.pdbqt | data/5E/5EHW-5OO/5EHW-5OO_target.pdbqt | data/5E/5EHW-5OO/5EHW-5OO_decoys.pdbqt | data/5E/5EHW-5OO/5EHW-5OO_decoy_scores.csv |
5E2L-DPN | data/5E/5E2L-DPN/5E2L-DPN_ligand.pdbqt | data/5E/5E2L-DPN/5E2L-DPN_target.pdbqt | data/5E/5E2L-DPN/5E2L-DPN_decoys.pdbqt | data/5E/5E2L-DPN/5E2L-DPN_decoy_scores.csv |
5EG7-MGT | data/5E/5EG7-MGT/5EG7-MGT_ligand.pdbqt | data/5E/5EG7-MGT/5EG7-MGT_target.pdbqt | data/5E/5EG7-MGT/5EG7-MGT_decoys.pdbqt | data/5E/5EG7-MGT/5EG7-MGT_decoy_scores.csv |
5EKT-FLC | data/5E/5EKT-FLC/5EKT-FLC_ligand.pdbqt | data/5E/5EKT-FLC/5EKT-FLC_target.pdbqt | data/5E/5EKT-FLC/5EKT-FLC_decoys.pdbqt | data/5E/5EKT-FLC/5EKT-FLC_decoy_scores.csv |
5EIF-SAM | data/5E/5EIF-SAM/5EIF-SAM_ligand.pdbqt | data/5E/5EIF-SAM/5EIF-SAM_target.pdbqt | data/5E/5EIF-SAM/5EIF-SAM_decoys.pdbqt | data/5E/5EIF-SAM/5EIF-SAM_decoy_scores.csv |
5E7Z-DPN | data/5E/5E7Z-DPN/5E7Z-DPN_ligand.pdbqt | data/5E/5E7Z-DPN/5E7Z-DPN_target.pdbqt | data/5E/5E7Z-DPN/5E7Z-DPN_decoys.pdbqt | data/5E/5E7Z-DPN/5E7Z-DPN_decoy_scores.csv |
5EKD-5BX | data/5E/5EKD-5BX/5EKD-5BX_ligand.pdbqt | data/5E/5EKD-5BX/5EKD-5BX_target.pdbqt | data/5E/5EKD-5BX/5EKD-5BX_decoys.pdbqt | data/5E/5EKD-5BX/5EKD-5BX_decoy_scores.csv |
5ESO-ISC | data/5E/5ESO-ISC/5ESO-ISC_ligand.pdbqt | data/5E/5ESO-ISC/5ESO-ISC_target.pdbqt | data/5E/5ESO-ISC/5ESO-ISC_decoys.pdbqt | data/5E/5ESO-ISC/5ESO-ISC_decoy_scores.csv |
5ENC-5QD | data/5E/5ENC-5QD/5ENC-5QD_ligand.pdbqt | data/5E/5ENC-5QD/5ENC-5QD_target.pdbqt | data/5E/5ENC-5QD/5ENC-5QD_decoys.pdbqt | data/5E/5ENC-5QD/5ENC-5QD_decoy_scores.csv |
5E88-5KT | data/5E/5E88-5KT/5E88-5KT_ligand.pdbqt | data/5E/5E88-5KT/5E88-5KT_target.pdbqt | data/5E/5E88-5KT/5E88-5KT_decoys.pdbqt | data/5E/5E88-5KT/5E88-5KT_decoy_scores.csv |
5ERR-ADP | data/5E/5ERR-ADP/5ERR-ADP_ligand.pdbqt | data/5E/5ERR-ADP/5ERR-ADP_target.pdbqt | data/5E/5ERR-ADP/5ERR-ADP_decoys.pdbqt | data/5E/5ERR-ADP/5ERR-ADP_decoy_scores.csv |
5E2M-V14 | data/5E/5E2M-V14/5E2M-V14_ligand.pdbqt | data/5E/5E2M-V14/5E2M-V14_target.pdbqt | data/5E/5E2M-V14/5E2M-V14_decoys.pdbqt | data/5E/5E2M-V14/5E2M-V14_decoy_scores.csv |
5EGA-GK0 | data/5E/5EGA-GK0/5EGA-GK0_ligand.pdbqt | data/5E/5EGA-GK0/5EGA-GK0_target.pdbqt | data/5E/5EGA-GK0/5EGA-GK0_decoys.pdbqt | data/5E/5EGA-GK0/5EGA-GK0_decoy_scores.csv |
5ELW-5LD | data/5E/5ELW-5LD/5ELW-5LD_ligand.pdbqt | data/5E/5ELW-5LD/5ELW-5LD_target.pdbqt | data/5E/5ELW-5LD/5ELW-5LD_decoys.pdbqt | data/5E/5ELW-5LD/5ELW-5LD_decoy_scores.csv |
5EAC-TBQ | data/5E/5EAC-TBQ/5EAC-TBQ_ligand.pdbqt | data/5E/5EAC-TBQ/5EAC-TBQ_target.pdbqt | data/5E/5EAC-TBQ/5EAC-TBQ_decoys.pdbqt | data/5E/5EAC-TBQ/5EAC-TBQ_decoy_scores.csv |
5EYD-5T1 | data/5E/5EYD-5T1/5EYD-5T1_ligand.pdbqt | data/5E/5EYD-5T1/5EYD-5T1_target.pdbqt | data/5E/5EYD-5T1/5EYD-5T1_decoys.pdbqt | data/5E/5EYD-5T1/5EYD-5T1_decoy_scores.csv |
5EGR-5NT | data/5E/5EGR-5NT/5EGR-5NT_ligand.pdbqt | data/5E/5EGR-5NT/5EGR-5NT_target.pdbqt | data/5E/5EGR-5NT/5EGR-5NT_decoys.pdbqt | data/5E/5EGR-5NT/5EGR-5NT_decoy_scores.csv |
5EKO-N17 | data/5E/5EKO-N17/5EKO-N17_ligand.pdbqt | data/5E/5EKO-N17/5EKO-N17_target.pdbqt | data/5E/5EKO-N17/5EKO-N17_decoys.pdbqt | data/5E/5EKO-N17/5EKO-N17_decoy_scores.csv |
5E40-DTY | data/5E/5E40-DTY/5E40-DTY_ligand.pdbqt | data/5E/5E40-DTY/5E40-DTY_target.pdbqt | data/5E/5E40-DTY/5E40-DTY_decoys.pdbqt | data/5E/5E40-DTY/5E40-DTY_decoy_scores.csv |
5EAU-FFF | data/5E/5EAU-FFF/5EAU-FFF_ligand.pdbqt | data/5E/5EAU-FFF/5EAU-FFF_target.pdbqt | data/5E/5EAU-FFF/5EAU-FFF_decoys.pdbqt | data/5E/5EAU-FFF/5EAU-FFF_decoy_scores.csv |
5EFW-FMN | data/5E/5EFW-FMN/5EFW-FMN_ligand.pdbqt | data/5E/5EFW-FMN/5EFW-FMN_target.pdbqt | data/5E/5EFW-FMN/5EFW-FMN_decoys.pdbqt | data/5E/5EFW-FMN/5EFW-FMN_decoy_scores.csv |
5EEI-SHH | data/5E/5EEI-SHH/5EEI-SHH_ligand.pdbqt | data/5E/5EEI-SHH/5EEI-SHH_target.pdbqt | data/5E/5EEI-SHH/5EEI-SHH_decoys.pdbqt | data/5E/5EEI-SHH/5EEI-SHH_decoy_scores.csv |
5EYP-GTP | data/5E/5EYP-GTP/5EYP-GTP_ligand.pdbqt | data/5E/5EYP-GTP/5EYP-GTP_target.pdbqt | data/5E/5EYP-GTP/5EYP-GTP_decoys.pdbqt | data/5E/5EYP-GTP/5EYP-GTP_decoy_scores.csv |
5EJQ-GLU | data/5E/5EJQ-GLU/5EJQ-GLU_ligand.pdbqt | data/5E/5EJQ-GLU/5EJQ-GLU_target.pdbqt | data/5E/5EJQ-GLU/5EJQ-GLU_decoys.pdbqt | data/5E/5EJQ-GLU/5EJQ-GLU_decoy_scores.csv |
5EEF-TSN | data/5E/5EEF-TSN/5EEF-TSN_ligand.pdbqt | data/5E/5EEF-TSN/5EEF-TSN_target.pdbqt | data/5E/5EEF-TSN/5EEF-TSN_decoys.pdbqt | data/5E/5EEF-TSN/5EEF-TSN_decoy_scores.csv |
5EQC-BTB | data/5E/5EQC-BTB/5EQC-BTB_ligand.pdbqt | data/5E/5EQC-BTB/5EQC-BTB_target.pdbqt | data/5E/5EQC-BTB/5EQC-BTB_decoys.pdbqt | data/5E/5EQC-BTB/5EQC-BTB_decoy_scores.csv |
5EYU-NAD | data/5E/5EYU-NAD/5EYU-NAD_ligand.pdbqt | data/5E/5EYU-NAD/5EYU-NAD_target.pdbqt | data/5E/5EYU-NAD/5EYU-NAD_decoys.pdbqt | data/5E/5EYU-NAD/5EYU-NAD_decoy_scores.csv |
5EQE-5R8 | data/5E/5EQE-5R8/5EQE-5R8_ligand.pdbqt | data/5E/5EQE-5R8/5EQE-5R8_target.pdbqt | data/5E/5EQE-5R8/5EQE-5R8_decoys.pdbqt | data/5E/5EQE-5R8/5EQE-5R8_decoy_scores.csv |
5E13-5J9 | data/5E/5E13-5J9/5E13-5J9_ligand.pdbqt | data/5E/5E13-5J9/5E13-5J9_target.pdbqt | data/5E/5E13-5J9/5E13-5J9_decoys.pdbqt | data/5E/5E13-5J9/5E13-5J9_decoy_scores.csv |
5EXY-CTP | data/5E/5EXY-CTP/5EXY-CTP_ligand.pdbqt | data/5E/5EXY-CTP/5EXY-CTP_target.pdbqt | data/5E/5EXY-CTP/5EXY-CTP_decoys.pdbqt | data/5E/5EXY-CTP/5EXY-CTP_decoy_scores.csv |
5EE8-MA4 | data/5E/5EE8-MA4/5EE8-MA4_ligand.pdbqt | data/5E/5EE8-MA4/5EE8-MA4_target.pdbqt | null | null |
5ECO-JAA | data/5E/5ECO-JAA/5ECO-JAA_ligand.pdbqt | data/5E/5ECO-JAA/5ECO-JAA_target.pdbqt | data/5E/5ECO-JAA/5ECO-JAA_decoys.pdbqt | data/5E/5ECO-JAA/5ECO-JAA_decoy_scores.csv |
5EEN-5OG | data/5E/5EEN-5OG/5EEN-5OG_ligand.pdbqt | data/5E/5EEN-5OG/5EEN-5OG_target.pdbqt | data/5E/5EEN-5OG/5EEN-5OG_decoys.pdbqt | data/5E/5EEN-5OG/5EEN-5OG_decoy_scores.csv |
5ETM-5RW | data/5E/5ETM-5RW/5ETM-5RW_ligand.pdbqt | data/5E/5ETM-5RW/5ETM-5RW_target.pdbqt | data/5E/5ETM-5RW/5ETM-5RW_decoys.pdbqt | data/5E/5ETM-5RW/5ETM-5RW_decoy_scores.csv |
5EJ8-TD6 | data/5E/5EJ8-TD6/5EJ8-TD6_ligand.pdbqt | data/5E/5EJ8-TD6/5EJ8-TD6_target.pdbqt | data/5E/5EJ8-TD6/5EJ8-TD6_decoys.pdbqt | data/5E/5EJ8-TD6/5EJ8-TD6_decoy_scores.csv |
5EZY-ACP | data/5E/5EZY-ACP/5EZY-ACP_ligand.pdbqt | data/5E/5EZY-ACP/5EZY-ACP_target.pdbqt | data/5E/5EZY-ACP/5EZY-ACP_decoys.pdbqt | data/5E/5EZY-ACP/5EZY-ACP_decoy_scores.csv |
5E4N-DTY | data/5E/5E4N-DTY/5E4N-DTY_ligand.pdbqt | data/5E/5E4N-DTY/5E4N-DTY_target.pdbqt | data/5E/5E4N-DTY/5E4N-DTY_decoys.pdbqt | data/5E/5E4N-DTY/5E4N-DTY_decoy_scores.csv |
5E93-5LL | data/5E/5E93-5LL/5E93-5LL_ligand.pdbqt | data/5E/5E93-5LL/5E93-5LL_target.pdbqt | data/5E/5E93-5LL/5E93-5LL_decoys.pdbqt | data/5E/5E93-5LL/5E93-5LL_decoy_scores.csv |
5E72-SAM | data/5E/5E72-SAM/5E72-SAM_ligand.pdbqt | data/5E/5E72-SAM/5E72-SAM_target.pdbqt | data/5E/5E72-SAM/5E72-SAM_decoys.pdbqt | data/5E/5E72-SAM/5E72-SAM_decoy_scores.csv |
5ER4-5RL | data/5E/5ER4-5RL/5ER4-5RL_ligand.pdbqt | data/5E/5ER4-5RL/5ER4-5RL_target.pdbqt | data/5E/5ER4-5RL/5ER4-5RL_decoys.pdbqt | data/5E/5ER4-5RL/5ER4-5RL_decoy_scores.csv |
5EQC-BGC | data/5E/5EQC-BGC/5EQC-BGC_ligand.pdbqt | data/5E/5EQC-BGC/5EQC-BGC_target.pdbqt | data/5E/5EQC-BGC/5EQC-BGC_decoys.pdbqt | data/5E/5EQC-BGC/5EQC-BGC_decoy_scores.csv |
5ETN-ATP | data/5E/5ETN-ATP/5ETN-ATP_ligand.pdbqt | data/5E/5ETN-ATP/5ETN-ATP_target.pdbqt | data/5E/5ETN-ATP/5ETN-ATP_decoys.pdbqt | data/5E/5ETN-ATP/5ETN-ATP_decoy_scores.csv |
5EBW-F09 | data/5E/5EBW-F09/5EBW-F09_ligand.pdbqt | data/5E/5EBW-F09/5EBW-F09_target.pdbqt | data/5E/5EBW-F09/5EBW-F09_decoys.pdbqt | data/5E/5EBW-F09/5EBW-F09_decoy_scores.csv |
5EMJ-5QJ | data/5E/5EMJ-5QJ/5EMJ-5QJ_ligand.pdbqt | data/5E/5EMJ-5QJ/5EMJ-5QJ_target.pdbqt | data/5E/5EMJ-5QJ/5EMJ-5QJ_decoys.pdbqt | data/5E/5EMJ-5QJ/5EMJ-5QJ_decoy_scores.csv |
5EP3-5QT | data/5E/5EP3-5QT/5EP3-5QT_ligand.pdbqt | data/5E/5EP3-5QT/5EP3-5QT_target.pdbqt | data/5E/5EP3-5QT/5EP3-5QT_decoys.pdbqt | data/5E/5EP3-5QT/5EP3-5QT_decoy_scores.csv |
5EXY-GTP | data/5E/5EXY-GTP/5EXY-GTP_ligand.pdbqt | data/5E/5EXY-GTP/5EXY-GTP_target.pdbqt | data/5E/5EXY-GTP/5EXY-GTP_decoys.pdbqt | data/5E/5EXY-GTP/5EXY-GTP_decoy_scores.csv |
5EBM-DGA | data/5E/5EBM-DGA/5EBM-DGA_ligand.pdbqt | data/5E/5EBM-DGA/5EBM-DGA_target.pdbqt | data/5E/5EBM-DGA/5EBM-DGA_decoys.pdbqt | data/5E/5EBM-DGA/5EBM-DGA_decoy_scores.csv |
5EIW-X0V | data/5E/5EIW-X0V/5EIW-X0V_ligand.pdbqt | data/5E/5EIW-X0V/5EIW-X0V_target.pdbqt | data/5E/5EIW-X0V/5EIW-X0V_decoys.pdbqt | data/5E/5EIW-X0V/5EIW-X0V_decoy_scores.csv |
5E91-5L4 | data/5E/5E91-5L4/5E91-5L4_ligand.pdbqt | data/5E/5E91-5L4/5E91-5L4_target.pdbqt | data/5E/5E91-5L4/5E91-5L4_decoys.pdbqt | data/5E/5E91-5L4/5E91-5L4_decoy_scores.csv |
5ERS-AMP | data/5E/5ERS-AMP/5ERS-AMP_ligand.pdbqt | data/5E/5ERS-AMP/5ERS-AMP_target.pdbqt | data/5E/5ERS-AMP/5ERS-AMP_decoys.pdbqt | data/5E/5ERS-AMP/5ERS-AMP_decoy_scores.csv |
5EAJ-FOL | data/5E/5EAJ-FOL/5EAJ-FOL_ligand.pdbqt | data/5E/5EAJ-FOL/5EAJ-FOL_target.pdbqt | data/5E/5EAJ-FOL/5EAJ-FOL_decoys.pdbqt | data/5E/5EAJ-FOL/5EAJ-FOL_decoy_scores.csv |
5EB3-UEG | data/5E/5EB3-UEG/5EB3-UEG_ligand.pdbqt | data/5E/5EB3-UEG/5EB3-UEG_target.pdbqt | data/5E/5EB3-UEG/5EB3-UEG_decoys.pdbqt | data/5E/5EB3-UEG/5EB3-UEG_decoy_scores.csv |
5E4F-ADP | data/5E/5E4F-ADP/5E4F-ADP_ligand.pdbqt | data/5E/5E4F-ADP/5E4F-ADP_target.pdbqt | null | null |
5EXZ-CTP | data/5E/5EXZ-CTP/5EXZ-CTP_ligand.pdbqt | data/5E/5EXZ-CTP/5EXZ-CTP_target.pdbqt | data/5E/5EXZ-CTP/5EXZ-CTP_decoys.pdbqt | data/5E/5EXZ-CTP/5EXZ-CTP_decoy_scores.csv |
5EI1-5OR | data/5E/5EI1-5OR/5EI1-5OR_ligand.pdbqt | data/5E/5EI1-5OR/5EI1-5OR_target.pdbqt | data/5E/5EI1-5OR/5EI1-5OR_decoys.pdbqt | data/5E/5EI1-5OR/5EI1-5OR_decoy_scores.csv |
5EYP-LOC | data/5E/5EYP-LOC/5EYP-LOC_ligand.pdbqt | data/5E/5EYP-LOC/5EYP-LOC_target.pdbqt | data/5E/5EYP-LOC/5EYP-LOC_decoys.pdbqt | data/5E/5EYP-LOC/5EYP-LOC_decoy_scores.csv |
5ECT-DUP | data/5E/5ECT-DUP/5ECT-DUP_ligand.pdbqt | data/5E/5ECT-DUP/5ECT-DUP_target.pdbqt | data/5E/5ECT-DUP/5ECT-DUP_decoys.pdbqt | data/5E/5ECT-DUP/5ECT-DUP_decoy_scores.csv |
5EHE-WWO | data/5E/5EHE-WWO/5EHE-WWO_ligand.pdbqt | data/5E/5EHE-WWO/5EHE-WWO_target.pdbqt | data/5E/5EHE-WWO/5EHE-WWO_decoys.pdbqt | data/5E/5EHE-WWO/5EHE-WWO_decoy_scores.csv |
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