Structure of PDB 3mpg Chain A Binding Site BS02
Receptor Information
>3mpg Chain A (length=426) Species:
1392
(Bacillus anthracis) [
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MNYLFKNGRYMNEEGKIVATDLLVQDGKIAKVAENITADNAEVIDVNGKL
IAPGLVDVHVHLREPGGEHKETIETGTLAAAKGGFTTICAMPNTRPVPDC
REHMEDLQNRIKEKAHVNVLPYGAITVRQAGSEMTDFETLKELGAFAFTD
DGVGVQDASMMLAAMKRAAKLNMAVVAHCEENTLINKGCVHEGKFSEKHG
LNGIPSVCESVHIARDILLAEAADCHYHVCHVSTKGSVRVIRDAKRAGIK
VTAEVTPHHLVLCEDDIPSADPNFKMNPPLRGKEDHEALIEGLLDGTIDM
IATDHAPHTAEEKAQGIERAPFGITGFETAFPLLYTNLVKKGIITLEQLI
QFLTEKPADTFGLEAGRLKEGRTADITIIDLEQEEEIDPTTFLSKGKNTP
FAGWKCQGWPVMTIVGGKIAWQKESA
Ligand information
Ligand ID
ZN
InChI
InChI=1S/Zn/q+2
InChIKey
PTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Zn+2]
Formula
Zn
Name
ZINC ION
ChEMBL
CHEMBL1236970
DrugBank
DB14532
ZINC
PDB chain
3mpg Chain A Residue 430 [
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Receptor-Ligand Complex Structure
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PDB
3mpg
Structure of dihydroorotase from Bacillus anthracis at 2.6A resolution.
Resolution
2.6 Å
Binding residue
(original residue number in PDB)
D151 H178 H231
Binding residue
(residue number reindexed from 1)
D151 H178 H231
Annotation score
1
Enzymatic activity
Catalytic site (original residue number in PDB)
H59 H61
Catalytic site (residue number reindexed from 1)
H59 H61
Enzyme Commision number
3.5.2.3
: dihydroorotase.
Gene Ontology
Molecular Function
GO:0004038
allantoinase activity
GO:0004151
dihydroorotase activity
GO:0008270
zinc ion binding
GO:0016787
hydrolase activity
GO:0016810
hydrolase activity, acting on carbon-nitrogen (but not peptide) bonds
GO:0016812
hydrolase activity, acting on carbon-nitrogen (but not peptide) bonds, in cyclic amides
GO:0046872
metal ion binding
Biological Process
GO:0006145
purine nucleobase catabolic process
GO:0006221
pyrimidine nucleotide biosynthetic process
GO:0044205
'de novo' UMP biosynthetic process
Cellular Component
GO:0005737
cytoplasm
View graph for
Molecular Function
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Biological Process
View graph for
Cellular Component
External links
PDB
RCSB:3mpg
,
PDBe:3mpg
,
PDBj:3mpg
PDBsum
3mpg
PubMed
21045288
UniProt
Q81WF0
|PYRC_BACAN Dihydroorotase (Gene Name=pyrC)
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