Structure of PDB 3lgg Chain B Binding Site BS01

Receptor Information
>3lgg Chain B (length=482) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SIDETRAHLLLKEKMMRLGGRLVLNTKEELANERLMTLKIAEMKEAMRTL
IFPPSMHFFQAKHLIERSQVFNILRMMPKGAALHLHDIGIVTMDWLVRNV
TYRPHCHICFTPRGIMQFRFAHPTPRPSEKCSKWILLEDYRKRVQNVTEF
DDSLLRNFTLVTQHPEVIYTNQNVVWSKFETIFFTISGLIHYAPVFRDYV
FRSMQEFYEDNVLYMEIRARLLPVYELSGEHHDEEWSVKTYQEVAQKFVE
THPEFIGIKIIYSDHRSKDVAVIAESIRMAMGLRIKFPTVVAGFDLVGHE
DTGHSLHDYKEALMIPAKDGVKLPYFFHAGETDWQGTSIDRNILDALMLN
TTRIGHGFALSKHPAVRTYSWKKDIPIEVCPISNQVLKLVSDLRNHPVAT
LMATGHPMVISSDDPAMFGAKGLSYDFYEVFMGIGGMKADLRTLKQLAMN
SIKYSTLLESEKNTFMEIWKKRWDKFIADVAT
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain3lgg Chain B Residue 512 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB3lgg Structural basis for the growth factor activity of human adenosine deaminase ADA2.
Resolution2.5 Å
Binding residue
(original residue number in PDB)		H86 H88 H330 D415
Binding residue
(residue number reindexed from 1)		H84 H86 H328 D413
Annotation score1
Enzymatic activity
Enzyme Commision number 3.5.4.4: adenosine deaminase.
Gene Ontology
Molecular Function
GO:0004000 adenosine deaminase activity
GO:0019239 deaminase activity
Biological Process
GO:0006154 adenosine catabolic process
Cellular Component
GO:0005615 extracellular space

View graph for
Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:3lgg, PDBe:3lgg, PDBj:3lgg
PDBsum3lgg
PubMed20147294
UniProtQ9NZK5|ADA2_HUMAN Adenosine deaminase 2 (Gene Name=ADA2)

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