MolNFT v1 · #153635 · protein
Crystal structure of BUBR1 kinase domain
6JKK · Mitotic checkpoint control protein kinase BUB1: “Crystal structure of BUBR1 kinase domain”. X-ray diffraction, 4 pockets (best druggability 0.58). MolNFT v1 #153635 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6JKK
- Type
- protein
- Length
- 334 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Mitotic checkpoint control protein kinase BUB1
- UniProt
- O76755
- Pockets
- 4 · best druggability 0.58
Structure
x-ray diffraction · 1 distinct chain · 40% helix, 19% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Mitotic checkpoint control protein kinase BUB1 | protein | 334 | 40% helix, 19% strand | O76755 |
Ligands and binding sites
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 230 | 0.58 | 0.79 | 31 | GOL |
| 2 | 71 | 0.57 | 0.88 | 17 | empty |
| 3 | 129 | 0.41 | 0.75 | 21 | empty |
| 4 | 52 | 0.35 | 0.78 | 12 | empty |
Compared structures
- 6JKK · Crystal structure of BubR1 kinase domain · 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 O76755
- Elsewhere: RCSB PDB 6JKK · PDBe 6JKK · UniProt O76755
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