MolNFT v1 · #19655 · protein
E175S mutant of bovine 70 kilodalton heat shock protein
1QQO · Hydrolase (acting on acid anhydrides): “E175S mutant of bovine 70 kilodalton heat shock protein”. X-ray diffraction, 4 ligands (ADP, MG, K), 2 pockets (best druggability 0.77). MolNFT v1 #19655 on GenesisL1: 3D structure, binding…
- PDB
- 1QQO
- Type
- protein
- Length
- 378 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Hydrolase (acting on acid anhydrides)
- UniProt
- P19120
- Ligands
- ADP, MG, K, CL
- Pockets
- 2 · best druggability 0.77
Structure
x-ray diffraction · 1 distinct chain · 39% helix, 29% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Hydrolase (acting on acid anhydrides) | protein | 378 | 39% helix, 29% strand | P19120 |
Ligands and binding sites
- ADP · Adenosine-5'-diphosphate · ligand · chains A
- MG · Magnesium ion · metal · chains A
- K · Potassium ion · metal · chains A
- CL · Chloride ion · ion · 2 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 696 | 0.77 | 0.82 | 81 | MG, K, ADP |
| 2 | 53 | 0.44 | 0.84 | 13 | empty |
Compared structures
- 1QQO · E175S mutant of bovine 70 kilodalton heat shock protein · the same entry in another collection · chain A against A, TM-score 1.00
- P19120 · AlphaFold monomer V2.0 prediction for heat shock cognate 71 kda protein (P19120) · a predicted model of the same protein · chain A against A, TM-score 0.89
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 P19120
- Elsewhere: RCSB PDB 1QQO · PDBe 1QQO · UniProt P19120
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