TB2: (4-tert-butylphenyl)acetaldehyde
TB2 is a Ligand Of Interest in 3R1B 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) |
| 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 |
|---|
| 3R1B_TB2_A_501 | 32% | 59% | 0.292 | 0.968 | 0.6 | 0.95 | - | 1 | 8 | 0 | 100% | 1 |
| 3R1B_TB2_B_501 | 27% | 61% | 0.304 | 0.954 | 0.6 | 0.88 | - | 1 | 3 | 0 | 100% | 1 |
| 3R1B_TB2_C_501 | 25% | 59% | 0.327 | 0.963 | 0.6 | 0.97 | - | 1 | 6 | 0 | 100% | 1 |
| 3R1B_TB2_D_501 | 3% | 31% | 0.511 | 0.865 | 0.69 | 2 | - | 1 | 12 | 0 | 100% | 1 |
| 3R1A_TB2_C_501 | 18% | 47% | 0.381 | 0.97 | 0.67 | 1.35 | - | 2 | 0 | 0 | 100% | 1 |
