Structure of PDB 5fch Chain B Binding Site BS03
Receptor Information
>5fch Chain B (length=395) Species:
190485
(Xanthomonas campestris pv. campestris str. ATCC 33913) [
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STQIGGMSLDQARTQLAPWTQRAAPIGADEYQQRIERARVLMRAQGVDAL
LIGAGTSLRYFSGVPWGASERLVALLLTTEGDPVLICPAFEEGSLDAVLQ
LPVRKRLWEEHEDPYALVVQAMDEQHAHALALDPGIAFAVHTGLRAHLGT
AIRDAGAIIDGCRMCKSPAELALMQQACDMTLLVQRLAAGIAHEGIGTDQ
LVRFIDEAHRALGADNGSTFCIVQFGHATAFPHGVQHLRAGELVLIDTGC
TVQGYHSDITRTWIYGTPSDAQQRIWELELAAQAAAFAAVRPGVACEAVD
QAARAVLQAAGLGPDYRLPGLPHRTGHGCGLAIHEAPYLVRGNRQPLQPG
MCASNEPMIVVPGAFGVRLEDHFYVTDTGAQWFTPPSVAIDQPFA
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
5fch Chain B Residue 402 [
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Receptor-Ligand Complex Structure
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PDB
5fch
Crystal structure and biochemical investigations reveal novel mode of substrate selectivity and illuminate substrate inhibition and allostericity in a subfamily of Xaa-Pro dipeptidases
Resolution
1.95 Å
Binding residue
(original residue number in PDB)
D251 D262 E374
Binding residue
(residue number reindexed from 1)
D247 D258 E370
Annotation score
1
Enzymatic activity
Catalytic site (original residue number in PDB)
H234 D251 D262 T264 H327 H331 H338 E360 V364 R372 E374
Catalytic site (residue number reindexed from 1)
H233 D247 D258 T260 H323 H327 H334 E356 V360 R368 E370
Enzyme Commision number
3.4.13.9
: Xaa-Pro dipeptidase.
Gene Ontology
Molecular Function
GO:0046872
metal ion binding
View graph for
Molecular Function
External links
PDB
RCSB:5fch
,
PDBe:5fch
,
PDBj:5fch
PDBsum
5fch
PubMed
27816563
UniProt
Q8P839
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