Structure of PDB 2ch2 Chain A Binding Site BS02
Receptor Information
>2ch2 Chain A (length=387) Species:
7165
(Anopheles gambiae) [
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FTPPPASLRNPLIIPEKIMMGPGPSNCSKRVLTAMTNTVLSNFHAELFRT
MDEVKDGLRYIFQTENRATMCVSGSAHAGMEAMLSNLLEEGDRVLIAVNG
IWAERAVEMSERYGADVRTIEGPPDRPFSLETLARAIELHQPKCLFLTHG
DSSSGLLQPLEGVGQICHQHDCLLIVDAVASLCGVPFYMDKWEIDAVYTG
AQKVLGAPPGITPISISPKALDVIRNRRTKSKVFYWDLLLLGNYWGCYDE
PKRYHHTVASNLIFALREALAQIAEEGLENQIKRRIECAQILYEGLGKMG
LDIFVKDPRHRLPTVTGIMIPKGVDWWKVSQYAMNNFSLEVQGGLGPTFG
KAWRVGIMGECSTVQKIQFYLYGFKESLKATHPDYIF
Ligand information
Ligand ID
KY1
InChI
InChI=1S/C10H11NO3/c11-8-4-2-1-3-7(8)9(12)5-6-10(13)14/h1-4H,5-6,11H2,(H,13,14)
InChIKey
BIASMBPERGWEBX-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
c1ccc(c(c1)C(=O)CCC(=O)O)N
CACTVS 3.341
Nc1ccccc1C(=O)CCC(O)=O
ACDLabs 10.04
O=C(c1ccccc1N)CCC(=O)O
Formula
C10 H11 N O3
Name
4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID
ChEMBL
CHEMBL1233898
DrugBank
DB08060
ZINC
ZINC000013356580
PDB chain
2ch2 Chain D Residue 1390 [
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Receptor-Ligand Complex Structure
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PDB
2ch2
Crystal Structure of the Anopheles Gambiae 3-Hydroxykynurenine Transaminase
Resolution
2.7 Å
Binding residue
(original residue number in PDB)
G25 S154 Q344 L347 R356
Binding residue
(residue number reindexed from 1)
G23 S152 Q342 L345 R354
Annotation score
2
Enzymatic activity
Enzyme Commision number
2.6.1.44
: alanine--glyoxylate transaminase.
2.6.1.63
: kynurenine--glyoxylate transaminase.
Gene Ontology
Molecular Function
GO:0004760
L-serine-pyruvate transaminase activity
GO:0008453
alanine-glyoxylate transaminase activity
GO:0008483
transaminase activity
GO:0016740
transferase activity
GO:0030170
pyridoxal phosphate binding
GO:0047315
kynurenine-glyoxylate transaminase activity
Biological Process
GO:0009436
glyoxylate catabolic process
GO:0019265
glycine biosynthetic process, by transamination of glyoxylate
GO:0097053
L-kynurenine catabolic process
Cellular Component
GO:0005777
peroxisome
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:2ch2
,
PDBe:2ch2
,
PDBj:2ch2
PDBsum
2ch2
PubMed
16585514
UniProt
Q7PRG3
|HKT_ANOGA 3-hydroxykynurenine transaminase (Gene Name=HKT)
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