MolNFT v1 · #86713 · protein
ATPase crystal structure with bound phosphate analogue
4BEV · Copper efflux ATPase: “ATPase crystal structure with bound phosphate analogue”. X-ray diffraction, 2 ligands (MGF, MG), 9 pockets (best druggability 0.70). MolNFT v1 #86713 on GenesisL1: 3D structure, binding sites and pockets in…
- PDB
- 4BEV
- Type
- protein
- Length
- 663 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Copper efflux ATPase
- EC
- 3.6.3.-
- UniProt
- Q5ZWR1
- Ligands
- MGF, MG
- Pockets
- 9 · best druggability 0.70
Structure
x-ray diffraction · 1 distinct chain · 49% helix, 14% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Copper efflux ATPase (EC 3.6.3.-) | protein | 663 | 49% helix, 14% strand | Q5ZWR1 |
Ligands and binding sites
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
9 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 614 | 0.70 | 0.78 | 77 | empty |
| 2 | 386 | 0.63 | 0.78 | 57 | empty |
| 3 | 139 | 0.41 | 0.75 | 22 | empty |
| 4 | 50 | 0.38 | 0.81 | 15 | empty |
| 5 | 64 | 0.30 | 0.74 | 13 | empty |
Compared structures
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 Q5ZWR1
- Elsewhere: RCSB PDB 4BEV · PDBe 4BEV · UniProt Q5ZWR1
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