Structure of PDB 5h2r Chain A Binding Site BS01

Receptor Information
>5h2r Chain A (length=329) Species: 185431 (Trypanosoma brucei brucei TREU927) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AITNREREAVLRIEFPNVDVTDIDFDLFQARESTDKPLDVAAAIAYRLLL
GSGLPQKFGCSDEVLLNFILQCRKKYRNVPYHNFYHVVDVCQTIYTFLYR
GNVYEKLTELECFVLLITALVHDLDHMGLNNSFYLKTESPLGILSSASGN
KSVLEVHHCNLAVEILSDPESDVFGGLEGAERTLAFRSMIDCVLATDMAR
HSEFLEKYLELMKTSYNVDDSDHRQMTMDVLMKAGDISNVTKPFDISRQW
AMAVTEEFYRQGDMEKERGVEVLPMFDRSKNMELAKGQIGFIDFVAAPFF
QKIVDACLQGMQWTVDRTKSNRAQWERVL
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 chain5h2r Chain A Residue 1001 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB5h2r Trypanosomal Phosphodiesterase B1 and B2 as a Potential Therapy for Human African Trypanosomiasis
Resolution1.8 Å
Binding residue
(original residue number in PDB)		H673 H709 D710 D823
Binding residue
(residue number reindexed from 1)		H86 H122 D123 D236
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.4.-
Gene Ontology
Molecular Function
GO:0004114 3',5'-cyclic-nucleotide phosphodiesterase activity
GO:0008081 phosphoric diester hydrolase activity
Biological Process
GO:0007165 signal transduction

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:5h2r, PDBe:5h2r, PDBj:5h2r
PDBsum5h2r
PubMed
UniProtQ38F42

[Back to BioLiP]