T. brucei TR · T15
T. brucei
PDB 9IFF
Protein: Trypanothione reductase
Binding site: Dimer cleft site
| # | Compound | Alt poses | Score ▲ | Final rank | Inter norm | H-bonds | Contacts | Jaccard | Contact recall | HB recall | HB role recall | Assessment ↕ | GDS |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 |
KB_HAT_187
T15
|
0 | -22.294 | 1.1485 | -0.8819 | 5 | 13 | - | - | Reject | — | ||
| 2 |
KB_chagas_35
T15
|
0 | -27.759 | 3.1821 | -0.9621 | 6 | 16 | - | - | Reject | — | ||
| 3 |
ulfkktlib_1417
T15
|
0 | -24.150 | 1.8594 | -1.8226 | 14 | 9 | - | - | Reject | — | ||
| 4 |
OSA_Lib_328
T15
|
0 | -25.106 | 3.0529 | -0.9190 | 2 | 12 | - | - | Weak | — | ||
| 5 |
OSA_Lib_239
T15
|
0 | -24.083 | 1.1949 | -0.8273 | 3 | 16 | - | - | Weak | — |
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