Structure of PDB 3bi6 Chain A

Receptor sequence
>3bi6A (length=258) Species: 9606 (Homo sapiens) [Search protein sequence]
SRYTTEFHELEKIGSGEFGSVFKCVKRLDGCIYAIKRSKKPLAGSVDEQN
ALREVYAHAVLGQHSHVVRYFSAWAEDDHMLIQNEYCNGGSLADAISENY
RIMSYFKEAELKDLLLQVGRGLRYIHSMSLVHMDIKPSNIFISKVMFKIG
DLGHVTRISSPQVEEGDSRFLANEVLQENYTHLPKADIFALALTVVCAAG
AEPLPRNGDQWHEIRQGRLPRIPQVLSQEFTELLKVMIHPDPERRPSAMA
LVKHSVLL
3D structure
PDB3bi6 Synthesis and structure-activity relationships of soluble 8-substituted 4-(2-chlorophenyl)-9-hydroxypyrrolo[3,4-c]carbazole-1,3(2H,6H)-diones as inhibitors of the Wee1 and Chk1 checkpoint kinases.
ChainA
Resolution2.2 Å
3D
structure
Catalytic site residues are labeled in the structure
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Enzymatic activity
Catalytic site (original residue number in PDB) D426 K428
Catalytic site (residue number reindexed from 1) D134 K136
Enzyme Commision number 2.7.10.2: non-specific protein-tyrosine kinase.
Interaction with ligand
Site
#		 Ligand Ligand
chain		 Binding residues on receptor
(original residue number in PDB)		 Binding residues on receptor
(residue number reindexed from 1)		 Binding affinity
BS01 396 A I305 A326 K328 V360 N376 E377 Y378 C379 G381 G382 F433 D463 I13 A34 K36 V68 N84 E85 Y86 C87 G89 G90 F141 D151 MOAD: ic50=15nM
PDBbind-CN: -logKd/Ki=7.82,IC50=15nM
BindingDB: IC50=15nM
Gene Ontology
Molecular Function
GO:0004672 protein kinase activity
GO:0005524 ATP binding
Biological Process
GO:0006468 protein phosphorylation

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Molecular Function
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Biological Process
External links
PDB RCSB:3bi6, PDBe:3bi6, PDBj:3bi6
PDBsum3bi6
PubMed18191399
UniProtP30291|WEE1_HUMAN Wee1-like protein kinase (Gene Name=WEE1)

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