MolNFT v1 · #143248 · protein
Crystal structure of SETDB1 tudor domain with aryl triazole fragments
6AU2: “Crystal structure of SETDB1 tudor domain with aryl triazole fragments”. X-ray diffraction, 3 ligands (CGJ, UNX, SO4). MolNFT v1 #143248 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6AU2
- Type
- protein
- Length
- 210 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- Q15047
- Ligands
- CGJ, UNX, SO4
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 210 | — | Q15047 |
Ligands and binding sites
- CGJ · 1-methyl-4H,6H-[1,2,4]triazolo[4,3-a][4,1]benzoxazepine · ligand · chains A
- UNX · Unknown atom or ion · ion · 13 copies · chains A
- SO4 · Sulfate ion · ion · 5 copies · chains A
- EDO · 1,2-ethanediol · additive · 6 copies · chains A
- BME · Beta-mercaptoethanol · additive · 2 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6AU2 · Crystal structure of SETDB1 Tudor domain with aryl triazole fragments · the same entry in another collection · chain A against A, TM-score 1.00
- Q15047 · AlphaFold monomer V2.0 prediction for histone-lysine N-methyltransferase SETDB1 (Q15047) · 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 Q15047
- Elsewhere: RCSB PDB 6AU2 · PDBe 6AU2 · UniProt Q15047
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