Structure of PDB 5jr6 Chain A Binding Site BS02

Receptor Information
>5jr6 Chain A (length=628) Species: 36329 (Plasmodium falciparum 3D7) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DNNPAARLEELRTIMKKNKIDVYILINSDEHNSEIINEKDKKIVKITNYS
GADGILIVTKDKPILYVNALYELQAMNELDQNLFTLRISRIDNRDEIFET
ISSLFNTIAFDGKNTSVVFYEKLRKALLNAYPKKKIVEKIIYNNNFDDVL
NFLVLEKSLVEIYPVNNKTLYIHDRKYNGACAGEKIDKLKQSLMYDIKNV
DNLLLSELDEIAYLLNLRGYDYQYSPLFYSYLLFQFDREQDFSKIVFFTT
VKNLPADVKNLLEINKVIVKEYEEIVPYLRDVVIPSIPKDFKKYDISLSP
YINLMIYKLFDRKNVLLQNSPVVKMKAVKNDVEIDNMKQAHILDGLALLQ
FFHWCEQKRKTKELFNETEMSLRHKVDYFRSTKKNFIFPSFSTISASGPN
AAVIHYECTDKTNATIKPAIYLLDSGGQYLHGTTDVTRTTHFGEPTAEEK
RIYTLVLKGHLRLRKVIFASYTNSSALDFIARENLFNNFMDYNHGTGHGV
GLTLNVHEGGCSIGPVGGAPLKKNMVLSNEPGYYMKDKFGVRIENMQYVI
SKEITDTTEYLSFDDLTMYPYEKKLLDFSLLTNQEIKELNEYHTTIRNTL
LPLVKQSPQEYGESVEKYLIEITEPIAI
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain5jr6 Chain A Residue 801 [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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PDB5jr6 Structure and substrate fingerprint of aminopeptidase P from Plasmodium falciparum.
Resolution2.3 Å
Binding residue
(original residue number in PDB)		D581 H644 E676 E690
Binding residue
(residue number reindexed from 1)		D435 H498 E530 E544
Annotation score4
Enzymatic activity
Enzyme Commision number 3.4.11.9: Xaa-Pro aminopeptidase.
Gene Ontology
Molecular Function
GO:0070006 metalloaminopeptidase activity

View graph for
Molecular Function
External links
PDB RCSB:5jr6, PDBe:5jr6, PDBj:5jr6
PDBsum5jr6
PubMed27462122
UniProtA0A144A2H0|AMPP_PLAF7 Aminopeptidase P (Gene Name=APP)

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