MolNFT v1 · #58056 · protein
Crystal structure analysis of chitinase a from vibrio harveyi with novel inhibitors - apo structure of mutant W275G
3ARS: “Crystal structure analysis of chitinase a from vibrio harveyi with novel inhibitors - apo structure of mutant…”. X-ray diffraction, 4 pockets (best druggability 0.74). MolNFT v1 #58056 on GenesisL1: 3D structure, binding sites and…
- PDB
- 3ARS
- Type
- protein
- Length
- 567 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Chitinase a
- EC
- 3.2.1.14
- UniProt
- Q9AMP1
- Pockets
- 4 · best druggability 0.74
Structure
x-ray diffraction · 1 distinct chain · 30% helix, 25% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Chitinase a (EC 3.2.1.14) | protein | 567 | 30% helix, 25% strand | Q9AMP1 |
Pockets
4 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 889 | 0.74 | 0.78 | 90 | empty |
| 2 | 156 | 0.41 | 0.74 | 19 | empty |
| 3 | 89 | 0.41 | 0.78 | 20 | empty |
| 4 | 75 | 0.32 | 0.75 | 22 | empty |
Modifications
Observed in the structure: 3 disulfide (disulfide).
Compared structures
- 3ARS · Crystal Structure Analysis of Chitinase A from Vibrio harveyi with novel inhibitors - apo… · 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 Q9AMP1
- Elsewhere: RCSB PDB 3ARS · PDBe 3ARS · UniProt Q9AMP1
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