MolNFT v1 · #144457 · protein
Crystal structure of the human vaccinia-related kinase bound to a bis- difluorophenol-aminopyridine inhibitor
6BU6: “Crystal structure of the human vaccinia-related kinase bound to a bis- difluorophenol-aminopyridine inhibitor”. X-ray diffraction, 3 ligands (E8V, CL, SO4). MolNFT v1 #144457 on GenesisL1: 3D structure, binding sites and pockets in…
- PDB
- 6BU6
- Type
- protein
- Length
- 1,262 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- Q99986
- Ligands
- E8V, CL, SO4
Structure
x-ray diffraction · 4 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 322 | — | Q99986 |
| B | — | protein | 307 | — | Q99986 |
| C | — | protein | 315 | — | Q99986 |
| D | — | protein | 318 | — | Q99986 |
Ligands and binding sites
- E8V · 4,4'-(2-aminopyridine-3,5-diyl)bis(2,6-difluorophenol) · ligand · 3 copies · chains A, B, D
- CL · Chloride ion · ion · 6 copies · chains A, B, C, D
- SO4 · Sulfate ion · ion · 5 copies · chains B, C, D
- GOL · Glycerol · additive · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6BU6 · Crystal Structure of the Human vaccinia-related kinase bound to a… · 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 Q99986
- Elsewhere: RCSB PDB 6BU6 · PDBe 6BU6 · UniProt Q99986
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