Structure of PDB 1a25 Chain B Binding Site BS04

Receptor Information
>1a25 Chain B (length=132) Species: 10116 (Rattus norvegicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ERRGRIYIQAHIDREVLIVVVRDAKNLVPMDPNGLSDPYVKLKLIPDPKS
ESKQKTKTIKCSLNPEWNETFRFQLKESDKDRRLSVEIWDWDLTSRNDFM
GSLSFGISELQKAGVDGWFKLLSQEEGEYFNV
Ligand information
Ligand IDPSE
InChIInChI=1S/C3H10NO5P/c4-3(1-5)2-9-10(6,7)8/h3,5H,1-2,4H2,(H2,6,7,8)/t3-/m1/s1
InChIKeyWDWYJNPKBKWDBL-GSVOUGTGSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C(COP(=O)(O)O)N)O
ACDLabs 10.04O=P(O)(O)OCC(N)CO
OpenEye OEToolkits 1.5.0C([C@H](COP(=O)(O)O)N)O
CACTVS 3.341N[CH](CO)CO[P](O)(O)=O
CACTVS 3.341N[C@H](CO)CO[P](O)(O)=O
FormulaC3 H10 N O5 P
NameO-PHOSPHOETHANOLAMINE
ChEMBL
DrugBank
ZINC
PDB chain1a25 Chain B Residue 1 [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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PDB1a25 Structure of the protein kinase Cbeta phospholipid-binding C2 domain complexed with Ca2+.
Resolution2.7 Å
Binding residue
(original residue number in PDB)		Y195 K197 K209 K211 W245 N253
Binding residue
(residue number reindexed from 1)		Y39 K41 K53 K55 W89 N97
Annotation score1
Enzymatic activity
Enzyme Commision number 2.7.11.13: protein kinase C.
External links
PDB RCSB:1a25, PDBe:1a25, PDBj:1a25
PDBsum1a25
PubMed9817842
UniProtP68403|KPCB_RAT Protein kinase C beta type (Gene Name=Prkcb)

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