Structure of PDB 3o0m Chain B Binding Site BS01
Receptor Information
>3o0m Chain B (length=135) Species:
246196
(Mycolicibacterium smegmatis MC2 155) [
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SCVFCAIVSGDAPAIRIYEDENFLGILDIRPFTRGHTLVIPKTHTVDLTD
TPPETVAGMAAVGQRIARAARESGLHADGNNIAINDGKAAFQTVFHIHLH
VVPRRNGDKLSFRRDPDREESGRLLRAALAQLDSA
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
3o0m Chain B Residue 151 [
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Receptor-Ligand Complex Structure
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PDB
3o0m
Increasing the structural coverage of tuberculosis drug targets.
Resolution
1.9 Å
Binding residue
(original residue number in PDB)
C3 C6 H45 H97
Binding residue
(residue number reindexed from 1)
C2 C5 H44 H96
Annotation score
1
Enzymatic activity
Catalytic site (original residue number in PDB)
N86 H97 H99 H101
Catalytic site (residue number reindexed from 1)
N85 H96 H98 H100
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0000166
nucleotide binding
GO:0003824
catalytic activity
GO:0046872
metal ion binding
GO:0047627
adenylylsulfatase activity
Biological Process
GO:0006790
sulfur compound metabolic process
GO:0009150
purine ribonucleotide metabolic process
View graph for
Molecular Function
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Biological Process
External links
PDB
RCSB:3o0m
,
PDBe:3o0m
,
PDBj:3o0m
PDBsum
3o0m
PubMed
25613812
UniProt
A0R291
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