MolNFT v1 · #149934 · protein
Crystal structure of mycobacterium tuberculosis cytochrome P450 CYP121A1 in complex with triazole pyrazole inhibitor 14A
6GEQ: “Crystal structure of mycobacterium tuberculosis cytochrome P450 CYP121A1 in complex with triazole pyrazole…”. X-ray diffraction, 3 ligands (HEM, EW5, SO4). MolNFT v1 #149934 on GenesisL1: 3D structure, binding sites and pockets in…
- PDB
- 6GEQ
- Type
- protein
- Length
- 395 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P9WPP6
- Ligands
- HEM, EW5, SO4
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 395 | — | P9WPP6 |
Ligands and binding sites
- HEM · Protoporphyrin IX containing Fe · ligand · chains A
- EW5 · 1-phenyl-3-pyridin-4-yl-~{N}-(pyridin-4-ylmethyl) pyrazole-4-carboxamide · ligand · chains A
- SO4 · Sulfate ion · ion · 2 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6GEQ · Crystal structure of Mycobacterium tuberculosis cytochrome P450 CYP121A1 in complex with… · the same entry in another collection · chain A against A, TM-score 1.00
- P9WPP6 · AlphaFold monomer V2.0 prediction for mycocyclosin synthase (P9WPP6) · 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 P9WPP6
- Elsewhere: RCSB PDB 6GEQ · PDBe 6GEQ · UniProt P9WPP6
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