Structure of PDB 2wvj Chain H Binding Site BS02

Receptor Information
>2wvj Chain H (length=166) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RGQIQVILGPMFSGKSTELMRRVRRFQIAQYKCLVIKYAKDTRYSSSMEA
LPACLLRDVAQEALGVAVIGIDEGQFFPDIVEFCEAMANAGKTVIVAALD
GTFQRKPFGAILNLVPLAESVVKLTAVCMECFREAAYSKRLGTEKEVEVI
GGADKYHSVCRLCYFK
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain2wvj Chain H Residue 1194 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB2wvj Comparative Active-Site Mutation Study of Human and Caenorhabditis Elegans Thymidine Kinase 1.
Resolution2.2 Å
Binding residue
(original residue number in PDB)		C153 C156 C185 C188
Binding residue
(residue number reindexed from 1)		C128 C131 C160 C163
Annotation score1
Enzymatic activity
Enzyme Commision number 2.7.1.21: thymidine kinase.
Gene Ontology
Molecular Function
GO:0004797 thymidine kinase activity
GO:0005524 ATP binding

View graph for
Molecular Function
External links
PDB RCSB:2wvj, PDBe:2wvj, PDBj:2wvj
PDBsum2wvj
PubMed22385435
UniProtP04183|KITH_HUMAN Thymidine kinase, cytosolic (Gene Name=TK1)

[Back to BioLiP]