Structure of PDB 7ceh Chain A Binding Site BS02

Receptor Information
>7ceh Chain A (length=259) Species: 1852 (Saccharomonospora viridis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DNPYERGPDPTEDSIEAIRGPFSVATERVSSFASGFGGGTIYYPRETDEG
TFGAVAVAPGFTASQGSMSWYGERVASQGFIVFTIDTNTRLDQPGQRGRQ
LLAALDYLVERSDRKVRERLDPNRLAVMGHAMGGGGSLEATVMRPSLKAS
IPLTPWNLDKTWGQVQVPTFIIGAELDTIAPVSTHAKPFYESLPSSLPKA
YMELDGATHFAPNIPNTTIAKYVISWLKRFVDEDTRYSQFLCPNPTDRAI
EEYRSTCPY
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain7ceh Chain A Residue 402 [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]
PDB7ceh Multiple structural states of Ca2+-regulated PET hydrolase, Cut190, and its correlation with activity and stability.
Resolution1.09 Å
Binding residue
(original residue number in PDB)		E220 D250 E296
Binding residue
(residue number reindexed from 1)		E175 D205 E251
Annotation score4
Enzymatic activity
Enzyme Commision number 3.1.1.74: cutinase.
External links