Attributes
UniProt ID
Protein Name
Cyanocobalamin reductase / alkylcobalamin dealkylase
Ligand Name
COBALAMIN
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
LKVIQTCSMMVGFU-DWSMJLPVSA-N
SMILES
Cc1cc2c(cc1C)n(cn2)C3C(C(C(O3)CO)OP(=O)(O)OC(C)CNC(=O)CCC4(C(C5C6(C(C(C7=[N]6[Co+2]89[N]5=C4C(=C1[NH]8C(=CC2=[N]9C(=C7C)C(C2CCC(=O)N)(C)CC(=O)N)C(C1CCC(=O)N)(C)C)C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3SOM
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Color Legend
Unassigned regionsLigand / hetero atomse3somA1e3somB1e3somC1e3somD1e3somE1e3somF1e3somG1e3somH1e3somI1e3somJ1e3somK1e3somL1e3somM1e3somN1e3somO1e3somP1
ECOD domains from experimental PDB structures interacting with ligand B12
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q9Y4U1 | n/a | B12 | 3som | e3somA1 | A:4-230 |
| Q9Y4U1 | n/a | B12 | 3som | e3somB1 | B:3-230 |
| Q9Y4U1 | n/a | B12 | 3som | e3somC1 | C:4-231 |
| Q9Y4U1 | n/a | B12 | 3som | e3somD1 | D:2-230 |
| Q9Y4U1 | n/a | B12 | 3som | e3somE1 | E:4-233 |
| Q9Y4U1 | n/a | B12 | 3som | e3somF1 | F:3-230 |
| Q9Y4U1 | n/a | B12 | 3som | e3somG1 | G:3-230 |
| Q9Y4U1 | n/a | B12 | 3som | e3somH1 | H:4-230 |
| Q9Y4U1 | n/a | B12 | 3som | e3somI1 | I:3-230 |
| Q9Y4U1 | n/a | B12 | 3som | e3somJ1 | J:4-230 |
| Q9Y4U1 | n/a | B12 | 3som | e3somK1 | K:4-230 |
| Q9Y4U1 | n/a | B12 | 3som | e3somL1 | L:3-233 |
| Q9Y4U1 | n/a | B12 | 3som | e3somM1 | M:2-232 |
| Q9Y4U1 | n/a | B12 | 3som | e3somN1 | N:4-235 |
| Q9Y4U1 | n/a | B12 | 3som | e3somO1 | O:4-231 |
| Q9Y4U1 | n/a | B12 | 3som | e3somP1 | P:2-231 |
| Q9Y4U1 | n/a | B12 | 5uos | e5uosA1 | A:-2-236 |