Structure of PDB 7c7d Chain A Binding Site BS01

Receptor Information
>7c7d Chain A (length=539) Species: 44061 (Streptomyces thermodiastaticus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AGADLPFTSVEAESATTTGTKIGPDYTQGTLASEASGRQAVRLDAGQRVE
FTVPRAANALTVAYSVPDGQSGTLDVYVNGTKLDRSLTVTSKYSYVDTGW
IPGAKTHHFYDNTRLLLGRDVQAGDTVTLQATNVQVTVDVADFEQVSAAA
GQPAGSVSVTDKGADPTGQGDSTQAFRDAIAAAQGGVVWIPPGDYRITGP
LSGVQNVTLQGAGSWYSVVHSSHFIDQTDSAGHVHLKDFAVIGEVTERVD
SSPDNFVNGSLGPGSSVSGMWIQHVKVGLWLTGTNDDLVVENNRILDTTA
DGLNLNGTAKNVTVRDNFLRNQGDDALAMWSLYAPDTDCRFENNTITQPN
LANGIAIYGGTDITVKGNLISDTNALGSGIAISNQKFAEPFHPLAGTITV
DGNTLVRTGAINPNWNHPMGALRVDSYDSAIEARVDITDTTITDSPYSAF
EFVSGGGQGHAVKNVTVDGAAVKNTGTVVVQAEAPGEATFRNVTATGTGA
AGIYNCPFPSGSGTFTVTDGGGNSGWDTTWSDCSTWPQP
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 chain7c7d Chain A Residue 701 [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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PDB7c7d Crystal structure of the catalytic unit of thermostable GH87 alpha-1,3-glucanase from Streptomyces thermodiastaticus strain HF3-3.
Resolution1.16 Å
Binding residue
(original residue number in PDB)		E63 E65 S88 Q91 D191
Binding residue
(residue number reindexed from 1)		E11 E13 S36 Q39 D139
Annotation score4
Enzymatic activity
Enzyme Commision number 3.2.1.59: glucan endo-1,3-alpha-glucosidase.
External links