MolNFT v1 · #164985 · protein
Btk in complex with LOU064, a potent and highly selective covalent inhibitor
6TFP: “Btk in complex with LOU064, a potent and highly selective covalent inhibitor”. X-ray diffraction, 2 ligands (N6Z, NA). MolNFT v1 #164985 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6TFP
- Type
- protein
- Length
- 1,335 residues
- Chains
- 5
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- Q06187
- Ligands
- N6Z, NA
Structure
x-ray diffraction · 4 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 266 | — | Q06187 |
| B | — | protein | 275 | — | Q06187 |
| C, E | — | protein | 264 | — | Q06187 |
| D | — | protein | 266 | — | Q06187 |
Ligands and binding sites
- N6Z · ~{N}-[3-[6-azanyl-5-[2-[methyl(propanoyl) amino]ethoxy]pyrimidin-4-yl]-5-fluoranyl-2-methyl-phenyl]-4-cyclopropyl-2-fluoranyl-benzamide · ligand · 5 copies · chains A, B, C, D, E
- NA · Sodium ion · metal · 2 copies · chains A, C
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6TFP · BTK in complex with LOU064, a potent and highly selective covalent inhibitor · the same entry in another collection · chain E against E, TM-score 1.00
- Q06187 · AlphaFold monomer V2.0 prediction for tyrosine-protein kinase btk (Q06187) · a predicted model of the same protein · chain A against A, TM-score 0.99
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 Q06187
- Elsewhere: RCSB PDB 6TFP · PDBe 6TFP · UniProt Q06187
GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.