1M3: N-tert-butyl-3-[(5-methyl-2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}pyrimidin-4-yl)amino]benzenesulfonamide
1M3 is a Ligand Of Interest in 5HEZ 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 same target (top 5) |
| 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 |
|---|
| 5HEZ_1M3_B_1203 | 62% | 20% | 0.185 | 0.977 | 1.18 | 2.18 | 3 | 14 | 0 | 0 | 100% | 1 |
| 5HEZ_1M3_C_1201 | 58% | 23% | 0.203 | 0.984 | 1.11 | 2.04 | 1 | 13 | 0 | 0 | 100% | 1 |
| 5HEZ_1M3_A_1203 | 54% | 31% | 0.214 | 0.979 | 0.92 | 1.81 | 1 | 9 | 2 | 0 | 100% | 1 |
| 5HEZ_1M3_B_1202 | 53% | 30% | 0.216 | 0.978 | 0.99 | 1.79 | 1 | 9 | 1 | 0 | 100% | 1 |
| 5HEZ_1M3_C_1202 | 52% | 29% | 0.2 | 0.96 | 0.98 | 1.84 | 2 | 7 | 1 | 0 | 100% | 1 |
| 5HEZ_1M3_A_1204 | 51% | 22% | 0.21 | 0.967 | 1.18 | 2.02 | 2 | 10 | 0 | 0 | 100% | 1 |
| 5HEZ_1M3_D_1203 | 49% | 21% | 0.214 | 0.964 | 1.34 | 1.92 | 2 | 11 | 0 | 0 | 100% | 1 |
| 5HEZ_1M3_D_1202 | 40% | 31% | 0.247 | 0.961 | 1.03 | 1.7 | 2 | 9 | 1 | 0 | 100% | 1 |
| 4JI9_1M3_B_1201 | 77% | 23% | 0.092 | 0.932 | 1.78 | 1.38 | 3 | 9 | 2 | 0 | 100% | 1 |
| 4O76_1M3_A_201 | 97% | 4% | 0.071 | 0.983 | 3.33 | 2.47 | 4 | 19 | 0 | 0 | 100% | 1 |
