Structure of PDB 1ltk Chain B Binding Site BS01
Receptor Information
>1ltk Chain B (length=415) Species:
5833
(Plasmodium falciparum) [
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HLGNKLSISDLKDIKNKKVLVRVDFNVPIENGIIKDTNRITATLPTINHL
KKEGASKIILISHCGRPDGLRNEKYTLKPVAETLKGLLGEEVLFLNDCVG
KEVEDKINAAKENSVILLENLRFHIEEEGKGVDANGNKVKANKEDVEKFQ
NDLTKLADVFINDAFGTAHRAHSSMVGVKLNVKASGFLMKKELEYFSKAL
ENPQRPLLAILGGAKVSDKIQLIKNLLDKVDRMIIGGGMAYTFKKVLNNM
KIGTSLFDEAGSKIVGEIMEKAKAKNVQIFLPVDFKIADNFDNNANTKFV
TDEEGIPDNWMGLDAGPKSIENYKDVILTSKTVIWNGPQGVFEMPNFAKG
SIECLNLVVEVTKKGAITIVGGGDTASLVEQQNKKNEISHVSTGGGASLE
LLEGKELPGVLALSN
Ligand information
Ligand ID
AMP
InChI
InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1
InChIKey
UDMBCSSLTHHNCD-KQYNXXCUSA-N
SMILES
Software
SMILES
CACTVS 3.370
Nc1ncnc2n(cnc12)[CH]3O[CH](CO[P](O)(O)=O)[CH](O)[CH]3O
CACTVS 3.370
Nc1ncnc2n(cnc12)[C@@H]3O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@H]3O
OpenEye OEToolkits 1.7.6
c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N
ACDLabs 12.01
O=P(O)(O)OCC3OC(n2cnc1c(ncnc12)N)C(O)C3O
OpenEye OEToolkits 1.7.6
c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)O)O)O)N
Formula
C10 H14 N5 O7 P
Name
ADENOSINE MONOPHOSPHATE
ChEMBL
CHEMBL752
DrugBank
DB00131
ZINC
ZINC000003860156
PDB chain
1ltk Chain B Residue 502 [
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Receptor-Ligand Complex Structure
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PDB
1ltk
CRYSTAL STRUCTURE OF PHOSPHOGLYCERATE KINASE FROM PLASMODIUM FALCIPARUM
Resolution
3.0 Å
Binding residue
(original residue number in PDB)
A214 K215 K219 G237 G340 V341 E343 D374
Binding residue
(residue number reindexed from 1)
A214 K215 K219 G237 G340 V341 E343 D374
Annotation score
4
Enzymatic activity
Catalytic site (original residue number in PDB)
R39 K215 G373 G396
Catalytic site (residue number reindexed from 1)
R39 K215 G373 G396
Enzyme Commision number
2.7.2.3
: phosphoglycerate kinase.
Gene Ontology
Molecular Function
GO:0004618
phosphoglycerate kinase activity
GO:0005524
ATP binding
GO:0016301
kinase activity
GO:0043531
ADP binding
Biological Process
GO:0006094
gluconeogenesis
GO:0006096
glycolytic process
GO:0016310
phosphorylation
Cellular Component
GO:0005829
cytosol
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:1ltk
,
PDBe:1ltk
,
PDBj:1ltk
PDBsum
1ltk
PubMed
UniProt
P27362
|PGK_PLAF7 Phosphoglycerate kinase (Gene Name=PGK)
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