MolNFT v1 · #174018 · protein
Crystal structure of human GSTA1-1 bound to the glutathione adduct of hexyl-isothiocyanate
7BIB: “Crystal structure of human GSTA1-1 bound to the glutathione adduct of hexyl-isothiocyanate”. X-ray diffraction, 1 ligand (TZ8). MolNFT v1 #174018 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 7BIB
- Type
- protein
- Length
- 429 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P08263
- Ligands
- TZ8
Structure
x-ray diffraction · 2 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 212 | — | P08263 |
| B | — | protein | 217 | — | P08263 |
Ligands and binding sites
- TZ8 · (2~{R})-2-azanyl-5-[[(2~{R})-3-(hexylcarbamothioylsulfanyl)-1-(2-hydroxy-2-oxoethylamino)-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid · ligand · 2 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 7BIB · Crystal structure of human GSTA1-1 bound to the glutathione adduct of hexyl-isothiocyanate · the same entry in another collection · 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 P08263
- Elsewhere: RCSB PDB 7BIB · PDBe 7BIB · UniProt P08263
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