MolNFT v1 · #130332 · protein
Humanized rat comt in complex with 6-(4-fluorophenyl)-8-hydroxy-3H- quinazolin-4-one
5PA4: “Humanized rat comt in complex with 6-(4-fluorophenyl)-8-hydroxy-3H- quinazolin-4-one”. X-ray diffraction, 3 ligands (7JD, MG, SO4). MolNFT v1 #130332 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 5PA4
- Type
- protein
- Length
- 214 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P22734
- Ligands
- 7JD, MG, SO4
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 214 | — | P22734 |
Ligands and binding sites
- 7JD · 6-(4-fluorophenyl)-8-oxidanyl-3~{H}-quinazolin-4-one · ligand · chains A
- MG · Magnesium ion · metal · chains A
- SO4 · Sulfate ion · ion · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- P22734 · AlphaFold monomer V2.0 prediction for catechol O-methyltransferase (P22734) · a predicted model of the same protein · chain A against A, TM-score 0.99
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt P22734
- Elsewhere: RCSB PDB 5PA4 · PDBe 5PA4 · UniProt P22734
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