2025-05-10_00000222
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ligand
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9F78
BAZ2A bromodomain in complex with acetylpyrrole derivative compound 28-TN23;
X-ray diffraction 1.70Å
Protein #1
105 residues (98% resolved)
Raw Sequence ...
SMHSDLTFCEIILMEMESHDAAWPFLEPVNPRLVSGYRRIIKNPMDFSTMRERLSRGGYTSSEEFAADALLVFDNCQTFNEDDSEVGKAGHIMRRFFESRWEEFY
Canonical Sequence ...
SMHSDLTFCEIILMEMESHDAAWPFLEPVNPRLVSGYRRIIKNPMDFSTMRERLSRGGYTSSEEFAADALLVFDNCQTFNEDDSEVGKAGHIMRRFFESRWEEFY
Non polymer #2
A1H98
InChI=1S/C19H27N5O3/c1-5-14-17(13(4)25)12(3)20-18(14)19(26)24-9-7-23(8-10-24)11-15-21-16(6-2)27-22-15/h20H,5-11H2,1-4H3
InChI=1S/C19H27N5O3/c1-5-14-17(13(4)25)12(3)20-18(14)19(26)24-9-7-23(8-10-24)11-15-21-16(6-2)27-22-15/h20H,5-11H2,1-4H3
SMILES: CCc1c(c([nH]c1C(=O)N2CCN(CC2)Cc3nc(on3)CC)C)C(=O)C
CCc1c(c([nH]c1C(=O)N2CCN(CC2)Cc3nc(on3)CC)C)C(=O)C
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
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Model
Reference
100%