Structure of PDB 9nse Chain B Binding Site BS01
Receptor Information
>9nse Chain B (length=414) Species:
9913
(Bos taurus) [
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KFPRVKNWELGSITYDTLCAQSQQDGPCTPRRCLGSLVLPRKLQTRPSPG
PPPAEQLLSQARDFINQYYSSIKRSGSQAHEERLQEVEAEVASTGTYHLR
ESELVFGAKQAWRNAPRCVGRIQWGKLQVFDARDCSSAQEMFTYICNHIK
YATNRGNLRSAITVFPQRAPGRGDFRIWNSQLVRYAGYRQQDGSVRGDPA
NVEITELCIQHGWTPGNGRFDVLPLLLQAPDEAPELFVLPPELVLEVPLE
HPTLEWFAALGLRWYALPAVSNMLLEIGGLEFSAAPFSGWYMSTEIGTRN
LCDPHRYNILEDVAVCMDLDTRTTSSLWKDKAAVEINLAVLHSFQLAKVT
IVDHHAATVSFMKHLDNEQKARGGCPADWAWIVPPISGSLTPVFHQEMVN
YILSPAFRYQPDPW
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
9nse Chain A Residue 900 [
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Receptor-Ligand Complex Structure
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PDB
9nse
Mapping the active site polarity in structures of endothelial nitric oxide synthase heme domain complexed with isothioureas.
Resolution
2.24 Å
Binding residue
(original residue number in PDB)
C96 C101
Binding residue
(residue number reindexed from 1)
C28 C33
Annotation score
1
Enzymatic activity
Catalytic site (original residue number in PDB)
C186 R189 W358 E363
Catalytic site (residue number reindexed from 1)
C118 R121 W290 E295
Enzyme Commision number
1.14.13.39
: nitric-oxide synthase (NADPH).
Gene Ontology
Molecular Function
GO:0004517
nitric-oxide synthase activity
Biological Process
GO:0006809
nitric oxide biosynthetic process
View graph for
Molecular Function
View graph for
Biological Process
External links
PDB
RCSB:9nse
,
PDBe:9nse
,
PDBj:9nse
PDBsum
9nse
PubMed
11051558
UniProt
P29473
|NOS3_BOVIN Nitric oxide synthase 3 (Gene Name=NOS3)
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