I3C: 5-amino-2,4,6-triiodobenzene-1,3-dicarboxylic acid
I3C is a Ligand Of Interest in 3E3D 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 |
3E3D_I3C_A_131 | 100% | 31% | 0.049 | 0.997 | 0.84 | 1.89 | - | 9 | 0 | 0 | 100% | 0.6 |
3E3D_I3C_A_132 | 90% | 41% | 0.104 | 0.988 | 0.88 | 1.41 | - | 4 | 0 | 0 | 100% | 0.31 |
3E3D_I3C_A_130 | 84% | 44% | 0.12 | 0.982 | 0.81 | 1.36 | - | 2 | 1 | 0 | 100% | 0.33 |
3E3D_I3C_A_133 | 44% | 30% | 0.2 | 0.929 | 0.85 | 1.92 | - | 7 | 0 | 0 | 100% | 0.25 |
6PBB_I3C_A_202 | 68% | 25% | 0.148 | 0.96 | 1.21 | 1.82 | 1 | 6 | 0 | 0 | 100% | 0.567 |
3GT4_I3C_A_301 | 100% | 30% | 0.043 | 0.997 | 0.94 | 1.84 | - | 8 | 0 | 0 | 100% | 0.9375 |
3Q7S_I3C_B_114 | 100% | 12% | 0.052 | 0.994 | 2.94 | 1.18 | 9 | 2 | 0 | 0 | 100% | 1 |
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 |