Structure of PDB 7cef Chain B Binding Site BS01

Receptor Information
>7cef Chain B (length=262) Species: 1852 (Saccharomonospora viridis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GPQDNPYERGPDPTEDSIEAIRGPFSVATERVSSFASGFGGGTIYYPRET
DEGTFGAVAVAPGFTASQGSMSWYGERVASQGFIVFTIDTNTRLDQPGQR
GRQLLAALDYLVERSDRKVRERLDPNRLAVMGHSMGGGGSLEATVMRPSL
KASIPLTPWNLDKTWGQVQVPTFIIGAELDTIAPVSTHAKPFYESLPSSL
PKAYMELDGATHFAPNIPNTTIAKYVISWLKRFVDEDTRYSQFLCPNPTD
RAIEEYRSTCPY
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 chain7cef Chain B Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7cef Multiple structural states of Ca2+-regulated PET hydrolase, Cut190, and its correlation with activity and stability.
Resolution1.6 Å
Binding residue
(original residue number in PDB)		G43 D46 E50
Binding residue
(residue number reindexed from 1)		G1 D4 E8
Annotation score4
Enzymatic activity
Enzyme Commision number 3.1.1.74: cutinase.
External links