B3N: 4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide
B3N is a Ligand Of Interest in 5THT 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 |
5THT_B3N_A_401 | 33% | 30% | 0.265 | 0.947 | 1.57 | 1.23 | 3 | 2 | 0 | 0 | 100% | 1 |
5THT_B3N_B_401 | 28% | 30% | 0.276 | 0.933 | 1.59 | 1.21 | 3 | 2 | 0 | 0 | 100% | 1 |
5THT_B3N_D_401 | 21% | 29% | 0.273 | 0.886 | 1.59 | 1.24 | 3 | 2 | 1 | 0 | 100% | 0.4091 |
5THT_B3N_C_401 | 13% | 31% | 0.355 | 0.894 | 1.5 | 1.26 | 3 | 3 | 2 | 0 | 100% | 1 |
5THV_B3N_B_404 | 86% | 30% | 0.103 | 0.973 | 1.59 | 1.22 | 3 | 3 | 0 | 0 | 100% | 1 |
7JVW_B3N_A_501 | 66% | 71% | 0.157 | 0.962 | 0.34 | 0.77 | - | - | 2 | 0 | 100% | 1 |
4QA1_B3N_B_404 | 65% | 64% | 0.141 | 0.944 | 0.38 | 0.98 | - | - | 1 | 0 | 100% | 1 |
4QA4_B3N_A_501 | 63% | 67% | 0.162 | 0.959 | 0.31 | 0.93 | - | 1 | 0 | 0 | 100% | 1 |
5DC5_B3N_B_403 | 59% | 58% | 0.181 | 0.965 | 0.36 | 1.24 | - | 4 | 1 | 0 | 100% | 1 |
4RSY_B3N_A_701 | 76% | 51% | 0.11 | 0.947 | 0.88 | 1 | 1 | 2 | 0 | 0 | 100% | 1 |
3Q9B_B3N_A_401 | 67% | 29% | 0.138 | 0.947 | 2.11 | 0.79 | 8 | - | 0 | 0 | 100% | 1 |