Brand  (β version)

PDB ID: 6GNH

Hetero Atom Contents

  The number of atoms exceeds 100,000.
  So, it can not be displayed here.

Select unit:

Select hetatm:   

close
information
centroid:
interaction residue:

Select chain:   Sequence  

Data format:   

Color scheme of protein:

Ligands
Code Name Style Show Link
F4T Methyl 4-(azepan-1-yl)-3-[(4-methoxyphenyl)sulfonylamino]benzoate PoSSuM
MYA Tetradecanoyl-CoA PoSSuM
Non-standard Residues
Code Name Show
Glycosylation
Code Name Emphasize
Modification
Code Name Show

Structure summary

Code : 6GNH   PDBj   RCSB PDB   PDBe
Header : TRANSFERASE
Title : Crystal Structure of Leishmania major N-Myristoyltransferase (NMT) With Bound Myristoyl-CoA and an Azepanyl Phenyl Benzylsulphonamide Ligand
Release Data : 2018-09-26
Compound :
mol_id molecule chains
1 Glycylpeptide N-tetradecanoyltransferase A
ec: 2.3.1.97
Source :
mol_id organism_scientific expression_system
1 Leishmania major  (taxid:5664) Escherichia coli  (taxid:562)
gene: NMT, LMJF_32_0080
Authors : Robinson, D.A., Harrison, J.R., Brand, S., Smith, V.C., Thompson, S., Smith, A., Davies, K., Mok, N.Y., Torrie, L.S., Collie, I., Hallyburton, I., Norval, S., Simeons, F.R.C., Stojanovski, L., Frearson, J.A., Brenk, R., Wyatt, P.G., Gilbert, I.H., Read, K.D.
Keywords : ACYLTRANSFERASE, TRANSFERASE, DRUG DISCOVERY
Exp. method : X-RAY DIFFRACTION ( 1.8900 Å )
Citation :

A Molecular Hybridization Approach for the Design of Potent, Highly Selective, and Brain-Penetrant N-Myristoyltransferase Inhibitors.

Harrison, J.R.,Brand, S.,Smith, V.  et al.
(2018)  J. Med. Chem.  61 : 8374 - 8389

PubMed: 30207721
DOI: 10.1021/acs.jmedchem.8b00884

Reaction

Chain : A
UniProt : Q4Q5S8 (Q4Q5S8_LEIMA)
Reaction: EC: Evidence:
Physiological Direction:
N-terminal glycyl-[protein] + tetradecanoyl-CoA = CoA + H(+) + N-tetradecanoylglycyl-[protein] 2.3.1.97 RuleBase:RU000586
-