JBR: 4-[(3-carboxy-2-oxidanyl-naphthalen-1-yl)methyl]-3-oxidanyl-naphthalene-2-carboxylic acid
JBR is a Ligand Of Interest in 7ERE designated by the Author
| Best-fitted instance in this entry |
| Other instances in this entry |
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 |
7ERE_JBR_A_402 | 43% | 41% | 0.146 | 0.867 | 1.15 | 1.14 | 2 | 3 | 1 | 0 | 100% | 1 |
7ERE_JBR_D_402 | 20% | 35% | 0.147 | 0.746 | 1.2 | 1.34 | 3 | 7 | 0 | 0 | 100% | 1 |
7ERE_JBR_C_402 | 13% | 39% | 0.225 | 0.765 | 1.24 | 1.15 | 2 | 3 | 3 | 0 | 100% | 1 |
7ERE_JBR_A_403 | 10% | 36% | 0.177 | 0.683 | 1.19 | 1.33 | 2 | 5 | 0 | 0 | 100% | 1 |