MolNFT v1 · #104028 · protein
Human apo comt
4PYI · Catechol O-methyltransferase: “Human apo comt”. X-ray diffraction, 1 ligand (NA), 1 pocket (best druggability 0.57). MolNFT v1 #104028 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 4PYI
- Type
- protein
- Length
- 207 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Catechol O-methyltransferase
- EC
- 2.1.1.6
- UniProt
- P21964
- Ligands
- NA
- Pockets
- 1 · best druggability 0.57
Structure
x-ray diffraction · 1 distinct chain · 49% helix, 25% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Catechol O-methyltransferase (EC 2.1.1.6) | protein | 207 | 49% helix, 25% strand | P21964 |
Ligands and binding sites
- NA · Sodium ion · metal · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 345 | 0.57 | 0.76 | 52 | empty |
Compared structures
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 P21964
- Elsewhere: RCSB PDB 4PYI · PDBe 4PYI · UniProt P21964
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