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3T9T

Crystal structure of BTK mutant (F435T,K596R) complexed with Imidazo[1,5-a]quinoxaline

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1ATyrosine-protein kinase ITK/TSKpolymer26730458.81UniProt (Q08881)
Pfam (PF07714)
In PDB
Homo sapiens (human)BTK, Bruton's Tyrosine Kinase, Kinase EMT, T-cell-specific kinase, Tyrosine-protein kinase Lyk
2A(2Z)-4-(dimethylamino)-N-{7-fluoro-4-[(2-methylphenyl)amino]imidazo[1,5-a]quinoxalin-8-yl}-N-methylbut-2-enamidenon-polymer432.51Chemie (IAQ)
3AGLYCEROLnon-polymer92.12Chemie (GOL)
4waterwater18.0114Chemie (HOH)
Sequence modifications
A: 354 - 620 (UniProt: Q08881)
PDBExternal DatabaseDetails
Thr 435Phe 435engineered mutation
Arg 596Lys 596engineered mutation
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains1
Total formula weight30458.8
Non-Polymers*Number of molecules3
Total formula weight616.7
All*Total formula weight31075.5
*Water molecules are not included.

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PDB entries from 2024-03-27

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