Structure of PDB 7m7d Chain A
Receptor sequence
>7m7dA (length=371) Species:
9606
(Homo sapiens) [
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ISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVE
KLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVP
YCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCS
KGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKA
LQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFA
GGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSL
ESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQ
QDLMNFLKTVRSTTEKSLLKE
3D structure
PDB
7m7d
Discovery of IACS-9779 and IACS-70465 as Potent Inhibitors Targeting Indoleamine 2,3-Dioxygenase 1 (IDO1) Apoenzyme.
Chain
A
Resolution
2.6 Å
3D
structure
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Enzymatic activity
Enzyme Commision number
1.13.11.52
: indoleamine 2,3-dioxygenase.
Interaction with ligand
Site
#
Ligand
Ligand
chain
Binding residues on receptor
(original residue number in PDB)
Binding residues on receptor
(residue number reindexed from 1)
Binding affinity
BS01
YRM
A
C129 F163 F226 R231 G262 S263 A264
C119 F153 F216 R221 G252 S253 A254
BS02
HEM
A
F163 S167 F214 I217 F226 A264 R343 H346 I349 V350 Y353 I354 L384 F387 L388
F153 S157 F204 I207 F216 A254 R333 H336 I339 V340 Y343 I344 L353 F356 L357
Gene Ontology
Molecular Function
GO:0004833
tryptophan 2,3-dioxygenase activity
GO:0009055
electron transfer activity
GO:0016702
oxidoreductase activity, acting on single donors with incorporation of molecular oxygen, incorporation of two atoms of oxygen
GO:0020037
heme binding
GO:0033754
indoleamine 2,3-dioxygenase activity
GO:0046872
metal ion binding
GO:0051213
dioxygenase activity
Biological Process
GO:0002376
immune system process
GO:0002666
positive regulation of T cell tolerance induction
GO:0002678
positive regulation of chronic inflammatory response
GO:0002830
positive regulation of type 2 immune response
GO:0006569
tryptophan catabolic process
GO:0006954
inflammatory response
GO:0007565
female pregnancy
GO:0019441
tryptophan catabolic process to kynurenine
GO:0019805
quinolinate biosynthetic process
GO:0032496
response to lipopolysaccharide
GO:0032693
negative regulation of interleukin-10 production
GO:0032735
positive regulation of interleukin-12 production
GO:0033555
multicellular organismal response to stress
GO:0034276
kynurenic acid biosynthetic process
GO:0034354
'de novo' NAD biosynthetic process from tryptophan
GO:0036269
swimming behavior
GO:0042098
T cell proliferation
GO:0042130
negative regulation of T cell proliferation
GO:0043065
positive regulation of apoptotic process
GO:0046006
regulation of activated T cell proliferation
GO:0070233
negative regulation of T cell apoptotic process
GO:0070234
positive regulation of T cell apoptotic process
Cellular Component
GO:0005737
cytoplasm
GO:0005829
cytosol
GO:0030485
smooth muscle contractile fiber
GO:0032421
stereocilium bundle
View graph for
Molecular Function
View graph for
Biological Process
View graph for
Cellular Component
External links
PDB
RCSB:7m7d
,
PDBe:7m7d
,
PDBj:7m7d
PDBsum
7m7d
PubMed
34292726
UniProt
P14902
|I23O1_HUMAN Indoleamine 2,3-dioxygenase 1 (Gene Name=IDO1)
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