MolNFT v1 · #112659 · protein
Human aurora a catalytic domain bound to sb-6-oh
4ZS0 · Aurora kinase a: “Human aurora a catalytic domain bound to sb-6-oh”. X-ray diffraction, 1 ligand (4QV), 1 pocket (best druggability 0.67). MolNFT v1 #112659 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 4ZS0
- Type
- protein
- Length
- 257 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Aurora kinase a
- EC
- 2.7.11.1
- UniProt
- O14965
- Ligands
- 4QV
- Pockets
- 1 · best druggability 0.67
Structure
x-ray diffraction · 1 distinct chain · 41% helix, 20% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Aurora kinase a (EC 2.7.11.1) | protein | 257 | 41% helix, 20% strand | O14965 |
Ligands and binding sites
- 4QV · 5-hydroxy-1'H-1,2'-bibenzimidazol-2(3H)-one · ligand · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 376 | 0.67 | 0.80 | 38 | 4QV |
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 O14965
- Elsewhere: RCSB PDB 4ZS0 · PDBe 4ZS0 · UniProt O14965
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