M77: 5-(1,4-DIAZEPAN-1-SULFONYL)ISOQUINOLINE
M77 is a Ligand Of Interest in 3TKU designated by the RCSB
| Best-fitted instance in this entry |
| Other instances in this entry |
| Best-fitted instance in this entry |
| Best-fitted PDB instances with different target (top 5) |
| Identifier | Ranking for goodness of fit | Ranking for geometry | Real space R factor | Real space correlation coefficient | RMSZ-bond-length | RMSZ-bond-angle | Outliers of bond length | Outliers of bond angle | Atomic clashes | Stereochemical errors | Model completeness | Average occupancy |
|---|
| 3TKU_M77_A_418 | 73% | 1% | 0.127 | 0.955 | 4.69 | 2.99 | 11 | 9 | 1 | 0 | 100% | 1 |
| 3TKU_M77_B_418 | 69% | 5% | 0.144 | 0.959 | 2.59 | 2.87 | 8 | 10 | 1 | 0 | 100% | 1 |
| 3TKU_M77_B_419 | 8% | 6% | 0.202 | 0.669 | 3.1 | 2.1 | 5 | 7 | 0 | 0 | 100% | 1 |
| 3TKU_M77_A_419 | 5% | 5% | 0.233 | 0.642 | 3.2 | 2.28 | 6 | 10 | 0 | 0 | 100% | 1 |
| 5O0E_M77_A_401 | 100% | 84% | 0.028 | 0.995 | 0.25 | 0.51 | - | - | 0 | 0 | 100% | 1 |
| 6EM2_M77_A_401 | 97% | 70% | 0.061 | 0.976 | 0.51 | 0.65 | - | - | 0 | 0 | 100% | 0.85 |
| 6I2A_M77_A_401 | 96% | 73% | 0.066 | 0.975 | 0.34 | 0.71 | - | 1 | 0 | 0 | 100% | 1 |
| 5OK3_M77_A_401 | 96% | 87% | 0.074 | 0.982 | 0.23 | 0.47 | - | - | 0 | 0 | 100% | 1 |
| 6I2C_M77_A_401 | 95% | 72% | 0.068 | 0.974 | 0.42 | 0.64 | - | - | 0 | 0 | 100% | 1 |
