pdb_id
stringlengths 7
10
| dpp_class
stringclasses 2
values | ligand_name
stringclasses 8
values | binding_type
stringclasses 5
values | coordinates
listlengths 26.9k
27.3k
| num_atoms
int64 26.9k
27.3k
|
|---|---|---|---|---|---|
frame_1888
|
dpp9
|
0005862
|
dpp8selective
| [[66.33000183105469,52.58000183105469,22.309999465942383],[66.29000091552734,53.52000045776367,22.69(...TRUNCATED)
| 26,876
|
frame_6932
|
dpp8
|
0005356
|
dpp9selective
| [[30.40999984741211,86.88999938964844,40.81999969482422],[30.93000030517578,87.25,41.61000061035156](...TRUNCATED)
| 27,286
|
frame_8938
|
dpp8
|
0005862
|
dpp8selective
| [[65.38999938964844,54.27000045776367,117.33000183105469],[65.22000122070312,53.439998626708984,116.(...TRUNCATED)
| 27,286
|
frame_9358
|
dpp9
|
12i
|
nonbinder
| [[43.63999938964844,73.83000183105469,101.80999755859375],[44.060001373291016,74.0,100.9100036621093(...TRUNCATED)
| 26,876
|
frame_2565
|
dpp8
|
000808
|
dpp8selective
| [[86.33999633789062,62.75,20.950000762939453],[87.19999694824219,62.33000183105469,20.64999961853027(...TRUNCATED)
| 27,286
|
frame_8716
|
dpp9
|
0003822
|
aselective
| [[113.27999877929688,60.34000015258789,50.66999816894531],[114.19999694824219,60.54999923706055,50.2(...TRUNCATED)
| 26,876
|
frame_3310
|
dpp8
|
0005356
|
dpp9selective
| [[59.91999816894531,31.43000030517578,94.58000183105469],[59.220001220703125,31.239999771118164,95.2(...TRUNCATED)
| 27,286
|
frame_2642
|
dpp9
|
42
|
dpp9selective
| [[114.97000122070312,95.37999725341797,72.08000183105469],[115.87000274658203,95.43000030517578,71.6(...TRUNCATED)
| 26,876
|
frame_425
|
dpp9
|
12i
|
nonbinder
| [[31.030000686645508,88.8499984741211,100.80000305175781],[30.959999084472656,89.16000366210938,101.(...TRUNCATED)
| 26,876
|
frame_3342
|
dpp9
|
12i
|
nonbinder
| [[123.68000030517578,80.04000091552734,60.220001220703125],[124.6500015258789,79.87000274658203,60.4(...TRUNCATED)
| 26,876
|
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