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PDBsum entry 4mle

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protein ligands links
Transferase/transferase activator PDB id
4mle
Jmol
Contents
Protein chain
448 a.a.
Ligands
GLC
VO1
PDB id:
4mle
Name: Transferase/transferase activator
Title: Human glucokinase in complex with novel amino thiazole activ
Structure: Glucokinase. Chain: a. Fragment: see remark 999. Synonym: hexokinase type iv, hk iv, hexokinase-4, hk4, hexo engineered: yes
Source: Homo sapiens. Human. Organism_taxid: 9606. Gene: gck. Expressed in: escherichia coli. Expression_system_taxid: 469008.
Resolution:
2.60Å     R-factor:   0.242     R-free:   0.289
Authors: W.C.Voegtli
Key ref: R.J.Hinklin et al. (2013). Identification of a new class of glucokinase activators through structure-based design. J Med Chem, 56, 7669-7678. PubMed id: 24015910 DOI: 10.1021/jm401116k
Date:
06-Sep-13     Release date:   25-Sep-13    
PROCHECK
Go to PROCHECK summary
 Headers
 References

Protein chain
Pfam   ArchSchema ?
P35557  (HXK4_HUMAN) -  Glucokinase
Seq:
Struc:
465 a.a.
448 a.a.*
Key:    PfamA domain  Secondary structure  CATH domain
* PDB and UniProt seqs differ at 2 residue positions (black crosses)

 Enzyme reactions 
   Enzyme class: E.C.2.7.1.2  - Glucokinase.
[IntEnz]   [ExPASy]   [KEGG]   [BRENDA]
      Reaction: ATP + D-glucose = ADP + D-glucose 6-phosphate
ATP
+
D-glucose
Bound ligand (Het Group name = GLC)
corresponds exactly
= ADP
+ D-glucose 6-phosphate
Molecule diagrams generated from .mol files obtained from the KEGG ftp site
 Gene Ontology (GO) functional annotation 
  GO annot!
  Cellular component     cytoplasm   9 terms 
  Biological process     metabolic process   36 terms 
  Biochemical function     catalytic activity     15 terms  

 

 
    reference    
 
 
DOI no: 10.1021/jm401116k J Med Chem 56:7669-7678 (2013)
PubMed id: 24015910  
 
 
Identification of a new class of glucokinase activators through structure-based design.
R.J.Hinklin, S.A.Boyd, M.J.Chicarelli, K.R.Condroski, W.E.DeWolf, P.A.Lee, W.Lee, A.Singh, L.Thomas, W.C.Voegtli, L.Williams, T.D.Aicher.
 
  ABSTRACT  
 
No abstract given.