Brand  (β version)

color scheme of protein:

hetatm:

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information
centroid:
interaction residue:

chain: Hide other chain(s)

Ligands
Code Name Link
0HY Methyl (3r)-3-(7-amino-4,5-dioxo-1,4,5,6-tetrahydropyrimido[4,5-C]pyridazin-3-yl)butanoate
LYS Lysine
SO4 Sulfate ion
Code : 4D8A
Header : TRANSFERASE/TRANSFERASE INHIBITOR
Title : Crystal structure of B. anthracis DHPS with compound 21
Release Data : 2012-04-04
Compound :
mol_id molecule chains
1 Dihydropteroate synthase A,B
ec: 2.5.1.15
Source :
mol_id organism_scientific organism_common expression_system
1 Bacillus anthracis  (taxid:191218) Anthrax Escherichia coli  (taxid:469008)
strain: A2012
gene: folP
expression_system_strain: BL21(DE3)
expression_system_vector_type: plasmid
expression_system_plasmid: pET28a
Authors : Hammoudeh, D., Lee, R.E., White, S.W.
Keywords : TIM Barrel, TIM narrel, Synthase, TRANSFERASE-TRANSFERASE INHIBITOR complex
Exp. method : X-RAY DIFFRACTION ( 2.183 Å )
Citation :

Structure-Based Design of Novel Pyrimido[4,5-c]pyridazine Derivatives as Dihydropteroate Synthase Inhibitors with Increased Affinity.

Zhao, Y.,Hammoudeh, D.,Yun, M.K.  et al.
(2012)  Chemmedchem  7 : 861 - 870

PubMed: 22416048
DOI: 10.1002/cmdc.201200049

Chain : A, B
UniProt : C3P9L8 (No found in current UniProtKB/SwissProt)
Reaction : -