MolNFT v1 · #173668 · protein
BAZ2A bromodomain in complex with compounds MS04 and B11
7B7G · Bromodomain adjacent to zinc finger domain protein 2A: “BAZ2A bromodomain in complex with compounds MS04 and B11”. X-ray diffraction, 2 ligands (T1B, T1E), 1 pocket (best druggability 0.47). MolNFT v1 #173668 on GenesisL1: 3D…
- PDB
- 7B7G
- Type
- protein
- Length
- 105 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Bromodomain adjacent to zinc finger domain protein 2A
- UniProt
- Q9UIF9
- Ligands
- T1B, T1E
- Pockets
- 1 · best druggability 0.47
Structure
x-ray diffraction · 1 distinct chain · 63% helix, 0% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Bromodomain adjacent to zinc finger domain protein 2A | protein | 105 | 63% helix, 0% strand | Q9UIF9 |
Ligands and binding sites
- T1B · 5-ethyl-2-(3-methyl-1,2,3-triazol-4-yl)-1~{H}-benzimidazole · ligand · chains A
- T1E · 1-[1-(3,5-dimethoxyphenyl)piperidin-4-yl]-2,3-dimethyl-guanidine · 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, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 84 | 0.47 | 0.81 | 19 | T1B |
Compared structures
- 7B7G · BAZ2A bromodomain in complex with compounds MS04 and B11 · the same entry in another collection · chain A against A, TM-score 1.00
- Q9UIF9 · AlphaFold monomer V2.0 prediction for bromodomain adjacent to zinc finger domain protein… · a predicted model of the same protein · chain A against A, TM-score 0.95
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 Q9UIF9
- Elsewhere: RCSB PDB 7B7G · PDBe 7B7G · UniProt Q9UIF9
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