Structure of PDB 1odz Chain A Binding Site BS02
Receptor Information
>1odz Chain A (length=379) Species:
155077
(Cellvibrio japonicus) [
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VKPVTVKLVDSQATMETRSLFAFMQEQRRHSIMFGHQHETTQGLTITRTD
GTQSDTFNAVGDFAAVYGWDTLSIVAPKAEGDIVAQVKKAYARGGIITVS
SHFDNPKTDTQKGVWPVGTSWDQTPAVVDSLPGGAYNPVLNGYLDQVAEW
ANNLKDEQGRLIPVIFRLYHENTGSWFWWGDKQSTPEQYKQLFRYSVEYL
RDVKGVRNFLYAYSPNNFWDVTEANYLERYPGDEWVDVLGFDTYGPVADN
ADWFRNVVANAALVARMAEARGKIPVISGIGIRAPDIEAGLYDNQWYRKL
ISGLKADPDAREIAFLLVWRNAPQGVPGGTQVPHYWVPANRPENINNGTL
EDFQAFYADEFTAFNRDIEQVYQRPTLIV
Ligand information
Ligand ID
BMA
InChI
InChI=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
InChIKey
WQZGKKKJIJFFOK-RWOPYEJCSA-N
SMILES
Software
SMILES
CACTVS 3.341
OC[C@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1O
OpenEye OEToolkits 1.5.0
C(C1C(C(C(C(O1)O)O)O)O)O
CACTVS 3.341
OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
OpenEye OEToolkits 1.5.0
C([C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O)O)O)O)O
ACDLabs 10.04
OC1C(O)C(OC(O)C1O)CO
Formula
C6 H12 O6
Name
beta-D-mannopyranose;
beta-D-mannose;
D-mannose;
mannose
ChEMBL
DrugBank
ZINC
ZINC000003830679
PDB chain
1odz Chain C Residue 2 [
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Receptor-Ligand Complex Structure
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PDB
1odz
Expansion of the Glycosynthase Repertoire to Produce Defined Manno-Oligosaccharides
Resolution
1.4 Å
Binding residue
(original residue number in PDB)
E121 W162 W360 R361 H377
Binding residue
(residue number reindexed from 1)
E80 W121 W319 R320 H334
Annotation score
4
Enzymatic activity
Enzyme Commision number
3.2.1.78
: mannan endo-1,4-beta-mannosidase.
Gene Ontology
Molecular Function
GO:0004553
hydrolase activity, hydrolyzing O-glycosyl compounds
GO:0016787
hydrolase activity
GO:0016798
hydrolase activity, acting on glycosyl bonds
GO:0016985
mannan endo-1,4-beta-mannosidase activity
Biological Process
GO:0000272
polysaccharide catabolic process
GO:0006080
substituted mannan metabolic process
GO:0010391
glucomannan metabolic process
GO:0051069
galactomannan metabolic process
View graph for
Molecular Function
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Biological Process
External links
PDB
RCSB:1odz
,
PDBe:1odz
,
PDBj:1odz
PDBsum
1odz
PubMed
12841226
UniProt
P49424
|MANA_CELJU Mannan endo-1,4-beta-mannosidase (Gene Name=manA)
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