Structure of PDB 4o7p Chain B Binding Site BS01

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 1 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB4o7p Homotypic dimerization of a maltose kinase for molecular scaffolding.
Resolution2.9 Å
Binding residue
(original residue number in PDB)		D322 H324 Y429 Y433
Binding residue
(residue number reindexed from 1)		D318 H320 Y425 Y429
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)

[Back to BioLiP]