Structure of PDB 2mpr Chain A Binding Site BS03

Receptor Information
>2mpr Chain A (length=421) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VDFHGYARSGIGWTGSGGEQQCFQATGAQSKYRLGNECETYAELKLGQEV
WKEGDKSFYFDTNVAYSVNQQNDWESTDPAFREANVQGKNLIEWLPGSTI
WAGKRFYQRHDVHMIDFYYWDISGPGAGIENIDLGFGKLSLAATRSTEAG
GSYTFSSQNIYDEVKDTANDVFDVRLAGLQTNPDGVLELGVDYGRANTTD
GYKLADGASKDGWMFTAEHTQSMLKGYNKFVVQYATDAMTTQGKGQARGS
DGSSSFTEKINYANKVINNNGNMWRILDHGAISLGDKWDLMYVGMYQNID
WDNNLGTEWWTVGVRPMYKWTPIMSTLLEVGYDNVKSQQTGDRNNQYKIT
LAQQWQAGDSIWSRPAIRIFATYAKWDEKWGYIKDGDNISRYAAATNSGI
STNSRGDSDEWTFGAQMEIWW
Ligand information
Ligand IDGLC
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-DVKNGEFBSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(O1)O)O)O)O)O
OpenEye OEToolkits 1.5.0C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O)O
CACTVS 3.341OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
CACTVS 3.341OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O
ACDLabs 10.04OC1C(O)C(OC(O)C1O)CO
FormulaC6 H12 O6
Namealpha-D-glucopyranose;
alpha-D-glucose;
D-glucose;
glucose
ChEMBLCHEMBL423707
DrugBank
ZINCZINC000003861213
PDB chain2mpr Chain D Residue 3 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2mpr Structure of maltoporin from Salmonella typhimurium ligated with a nitrophenyl-maltotrioside.
Resolution2.4 Å
Binding residue
(original residue number in PDB)		D111 H113
Binding residue
(residue number reindexed from 1)		D111 H113
Annotation score3
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0015144 carbohydrate transmembrane transporter activity
GO:0015288 porin activity
Biological Process
GO:0006811 monoatomic ion transport
GO:0015768 maltose transport
GO:0015774 polysaccharide transport
GO:0034219 carbohydrate transmembrane transport
Cellular Component
GO:0009279 cell outer membrane
GO:0016020 membrane
GO:0046930 pore complex

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:2mpr, PDBe:2mpr, PDBj:2mpr
PDBsum2mpr
PubMed9102468
UniProtP26466|LAMB_SALTY Maltoporin (Gene Name=lamB)

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