MolNFT v1 · #167781 · protein
Crystal structure of eis from mycobacterium tuberculosis in complex with inhibitor SGT1358
6VV3: “Crystal structure of eis from mycobacterium tuberculosis in complex with inhibitor SGT1358”. X-ray diffraction, 3 ligands (RM7, CL, SO4). MolNFT v1 #167781 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6VV3
- Type
- protein
- Length
- 396 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P9WFK7
- Ligands
- RM7, CL, SO4
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 396 | — | P9WFK7 |
Ligands and binding sites
- RM7 · 2-[(4-amino-6,7,8,9-tetrahydro-5H-cyclohepta[4, 5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[2-(piperidin-1-yl)ethyl]acetamide · ligand · chains A
- CL · Chloride ion · ion · 2 copies
- SO4 · Sulfate ion · ion · chains A
- PEG · Di(hydroxyethyl)ether · additive · 2 copies · chains A
- DMS · Dimethyl sulfoxide · additive · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6VV3 · Crystal structure of Eis from Mycobacterium tuberculosis in complex with inhibitor SGT1358 · the same entry in another collection · chain A against A, TM-score 1.00
- P9WFK7 · AlphaFold monomer V2.0 prediction for N-acetyltransferase eis (P9WFK7) · a predicted model of the same protein · chain A against A, TM-score 1.00
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 P9WFK7
- Elsewhere: RCSB PDB 6VV3 · PDBe 6VV3 · UniProt P9WFK7
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