MolNFT v1 · #136128 · protein
Crystal structure of mycobacterium tuberculosis dihydrofolate reductase bound P218 inhibitor
5UJF: “Crystal structure of mycobacterium tuberculosis dihydrofolate reductase bound P218 inhibitor”. X-ray diffraction, 2 ligands (MMV, SO4). MolNFT v1 #136128 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 5UJF
- Type
- protein
- Length
- 161 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P9WNX1
- Ligands
- MMV, SO4
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 161 | — | P9WNX1 |
Ligands and binding sites
- MMV · 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl) oxy]propoxy}phenyl)propanoic acid · ligand · chains A
- SO4 · Sulfate ion · ion · 3 copies · chains A
- EDO · 1,2-ethanediol · additive · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 5UJF · Crystal Structure of Mycobacterium tuberculosis Dihydrofolate Reductase Bound p218… · the same entry in another collection · chain A against A, TM-score 1.00
- P9WNX1 · AlphaFold monomer V2.0 prediction for dihydrofolate reductase (P9WNX1) · a predicted model of the same protein · chain A against A, TM-score 0.97
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 P9WNX1
- Elsewhere: RCSB PDB 5UJF · PDBe 5UJF · UniProt P9WNX1
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