Structure of PDB 4o7p Chain B Binding Site BS02

Receptor Information
>4o7p Chain B (length=451) Species: 1773 (Mycobacterium tuberculosis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DTLATKLPWSDWLSRQRWYAGRNRELATVKPGVVVALRHNLDLVLVDVTY
TDGATERYQVLVGWDFEPASEYGTKAAIGVADDRTGFDALYDVAGPQFLL
SLIVSSAVCGTSTGEVTFTREPDVELPFAAQPRVCDAEQSNTSVIFDRRA
ILKVFRRVSSGINPDIELNRVLTRAGNPHVARLLGAYQFGRPNRSPTDAL
AYALGMVTEYEANAAEGWAMATASVRDLFAEGDLYAHEVGGDFAGESYRL
GEAVASVHATLADSLGTAQATFPVDRMLARLSSTVAVVPELREYAPTIEQ
QFQKLAAEAITVQRVHGDLHLGQVLRTPESWLLIDFEGEPGQPLDERRAP
DSPLRDVAGVLRSFEYAAYGPLVDQATDKQLAARAREWVERNRAAFCDGY
AVASGIDPRDSALLLGAYELDKAVYETGYETRHRPGWLPIPLRSIARLTA
S
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 chain4o7p Chain C Residue 2 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4o7p Homotypic dimerization of a maltose kinase for molecular scaffolding.
Resolution2.9 Å
Binding residue
(original residue number in PDB)		W222 H324 S367 Y370 E430 R438
Binding residue
(residue number reindexed from 1)		W218 H320 S363 Y366 E426 R434
Annotation score3
Enzymatic activity
Enzyme Commision number 2.7.1.175: maltokinase.
Gene Ontology
Molecular Function
GO:0005515 protein binding
GO:0005524 ATP binding
GO:0016301 kinase activity
Biological Process
GO:0005978 glycogen biosynthetic process
GO:0005992 trehalose biosynthetic process
GO:0016310 phosphorylation
GO:0046835 carbohydrate phosphorylation
Cellular Component
GO:0005829 cytosol
GO:0005886 plasma membrane

View graph for
Molecular Function
View graph for
Biological Process
View graph for
Cellular Component
External links
PDB RCSB:4o7p, PDBe:4o7p, PDBj:4o7p
PDBsum4o7p
PubMed25245657
UniProtO07177|MAK1_MYCTU Maltokinase (Gene Name=mak)

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