MolNFT v1 · #189012 · protein
Crystallographic snapshots of ternary complexes of thermophilic secondary alcohol dehydrogenase from thermoanaerobacter pseudoethanolicus reveal the dynamics of ligand exchange and the proton relay network.
7UX4: “Crystallographic snapshots of ternary complexes of thermophilic secondary alcohol dehydrogenase from…”. X-ray diffraction, 5 ligands (NAP, NWO, K). MolNFT v1 #189012 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 7UX4
- Type
- protein
- Length
- 1,406 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P14941
- Ligands
- NAP, NWO, K, ZN, CL
Structure
x-ray diffraction · 2 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 350 | — | P14941 |
| B, C, D | — | protein | 352 | — | P14941 |
Ligands and binding sites
- NAP · Nadp nicotinamide-adenine-dinucleotide phosphate · ligand · 4 copies · chains A, B, C, D
- NWO · (1S,3S)-3-methylcyclohexan-1-ol · ligand · 3 copies · chains A, B, D
- K · Potassium ion · metal · 8 copies · chains A, B, C, D
- ZN · Zinc ion · metal · 4 copies · chains A, B, C, D
- CL · Chloride ion · ion · 2 copies · chains A, C, B, D
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 7UX4 · Crystallographic snapshots of ternary complexes of thermophilic secondary alcohol… · the same entry in another collection · chain D against D, TM-score 1.00
- P14941 · AlphaFold monomer V2.0 prediction for NADP-dependent isopropanol dehydrogenase (P14941) · a predicted model of the same protein · chain C 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 P14941
- Elsewhere: RCSB PDB 7UX4 · PDBe 7UX4 · UniProt P14941
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