I3C: 5-amino-2,4,6-triiodobenzene-1,3-dicarboxylic acid
I3C is a Ligand Of Interest in 3Q7S 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 |
3Q7S_I3C_B_114 | 100% | 12% | 0.052 | 0.994 | 2.94 | 1.18 | 9 | 2 | 0 | 0 | 100% | 1 |
3Q7S_I3C_A_114 | 86% | 10% | 0.107 | 0.977 | 2.74 | 1.55 | 9 | 5 | 1 | 0 | 100% | 0.56 |
3Q7S_I3C_B_115 | 84% | 6% | 0.121 | 0.984 | 3.38 | 1.72 | 7 | 5 | 2 | 0 | 100% | 0.66 |
3GT4_I3C_A_301 | 100% | 30% | 0.043 | 0.997 | 0.94 | 1.84 | - | 8 | 0 | 0 | 100% | 0.9375 |
3E3D_I3C_A_131 | 100% | 31% | 0.049 | 0.997 | 0.84 | 1.89 | - | 9 | 0 | 0 | 100% | 0.6 |
2Y1B_I3C_A_1133 | 99% | 23% | 0.057 | 0.994 | 1.34 | 1.84 | 3 | 7 | 0 | 0 | 100% | 1 |
3E79_I3C_A_500 | 98% | 43% | 0.072 | 0.997 | 1.01 | 1.2 | - | 4 | 1 | 0 | 100% | 1 |
4BVX_I3C_B_1169 | 98% | 11% | 0.071 | 0.99 | 3 | 1.23 | 9 | 3 | 3 | 0 | 100% | 0.75 |