Structure of PDB 5cvy Chain A Binding Site BS04

Receptor Information
>5cvy Chain A (length=701) Species: 315750 (Bacillus pumilus SAFR-032) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SNKERFLTLYHQIKSDANGYFSPEGIPYHSIETLICEAPDYGHMTTSEAY
SYWLWLEVLYGHYTRDWSKLEAAWDNMEKYIIPVNEDGNDEQPHMSAYNP
SSPATYASEKPYPDQYPSQLSGARPAGQDPIDGELKSTYGTNETYLMHWL
LDVDNWYKYGNLLNPSHKAAYVNTFQRGQQESVWEAIPHPSQDDKSFGKP
NEGFMSLFTKENQVPAAQWRYTNATDADARAIQAIYWAKELGYNNSTYLD
KAKKMGDFLRYGMYDKYFQTIGSGKQGNPYPGNGKGACHYLMAWYTSWGG
GLGDYANWSWRIGASHCHQGYQNPVAAYALSSDKGGLKPSSATGASDWEK
TLKRQLEFYVWLQSKEGAIAGGATNSWNGDYSAYPAGRSTFYDMAYEDAP
VYHDPPSNNWFGMQAWPMERVAELYYIFVKDGDKTSENVQMAKSCITKWV
NYALDYIFIGSRPVSDEEGYFLDDQGRRILGGTNATVATTSAPGEFWLPG
NIAWSGQPDTWNGFQSATGNPNLTAVTKDPTQDTGVLGSLVKAFTFFAAA
TKLETGNYTALGVRAKDAAAQLLEVAWNYNDGVGIVTEEEREDYDRFFKK
EVYFPNGWNGTFGQGNQIPGSSTIPSDPQRGGNGVYTSFADLRPNIKQDP
AWSSLESKYQSSFNEATGKWENGAPVFTYHRFWSQVDMATAYAEYHRLIN
L
Ligand information
Ligand IDBGC
InChIInChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1
InChIKeyWQZGKKKJIJFFOK-VFUOTHLCSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.6C(C1C(C(C(C(O1)O)O)O)O)O
CACTVS 3.370OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O
CACTVS 3.370OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
OpenEye OEToolkits 1.7.6C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O
ACDLabs 12.01OC1C(O)C(OC(O)C1O)CO
FormulaC6 H12 O6
Namebeta-D-glucopyranose;
beta-D-glucose;
D-glucose;
glucose
ChEMBLCHEMBL1614854
DrugBankDB02379
ZINCZINC000003833800
PDB chain5cvy Chain C Residue 2 [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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PDB5cvy Natural diversity of glycoside hydrolase family 48 exoglucanases: insights from structure.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		W150 F176 T223 Y296 Y403
Binding residue
(residue number reindexed from 1)		W149 F175 T222 Y295 Y402
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003824 catalytic activity
GO:0004553 hydrolase activity, hydrolyzing O-glycosyl compounds
GO:0008810 cellulase activity
GO:0016787 hydrolase activity
GO:0046872 metal ion binding
Biological Process
GO:0005975 carbohydrate metabolic process
GO:0030245 cellulose catabolic process

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:5cvy, PDBe:5cvy, PDBj:5cvy
PDBsum5cvy
PubMed29213319
UniProtA8FDC4

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