Structure of PDB 4tqt Chain B Binding Site BS01

Receptor Information
>4tqt Chain B (length=477) Species: 204722 (Brucella suis 1330) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ASKVIKGGTVITADRTFRADILIEDGKIAAIGDSLEGDEVIDASGCYVMP
GGIDPHTHLQMPFMGTYSSDDFDTGTAAALAGGTTMVVDFVLPDSEGNLL
DALQEWFQKAGKARTDYSFHMAITGWNERTFNEMAEVVKRGINTFKHFMA
YKGALMVNDDEMFASFQRCAELGAMPLVHAENGDIVAQLQAKLMAEGNDG
PEAHAYSRPPEVEGEATNRAIMIADQAGVPLYVVHVSCEQSHEAIRRARQ
KGMRVFGEPLIQHLTLDESEYHNRDWDYAARRVMSPPFRDKLNQDSLWAG
LAAGSLQCVATDHCAFTTEQKRYGIGNFTKIPNGTGGLEERMPVLWTRGV
RTGRLTPNEFVAVTSTNIAKILNIYPQKGAVVPGADADLVIWDPETTKKI
SAKTQHSSIDYNVFEGFELKGLPIMTLSRGRIAFDKGQVTAKPGDGRFIE
REPNGAVNRALSQWKEIVAPRKVERSA
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 chain4tqt Chain B Residue 500 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB4tqt Crystal structure of Dihydropyrimidinase from Brucella suis
Resolution2.15 Å
Binding residue
(original residue number in PDB)		H61 H63 K151 D317
Binding residue
(residue number reindexed from 1)		H56 H58 K146 D312
Annotation score1
Enzymatic activity
Enzyme Commision number 3.5.2.2: dihydropyrimidinase.
Gene Ontology
Molecular Function
GO:0004157 dihydropyrimidinase activity
GO:0016787 hydrolase activity
GO:0016810 hydrolase activity, acting on carbon-nitrogen (but not peptide) bonds
GO:0046872 metal ion binding
Cellular Component
GO:0005737 cytoplasm

View graph for
Molecular Function
View graph for
Cellular Component
External links
PDB RCSB:4tqt, PDBe:4tqt, PDBj:4tqt
PDBsum4tqt
PubMed
UniProtA0A0H3G9X2

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