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Zinc in PDB 4c81: Ispf (Plasmodium Falciparum) Cdp Complex

Enzymatic activity of Ispf (Plasmodium Falciparum) Cdp Complex

All present enzymatic activity of Ispf (Plasmodium Falciparum) Cdp Complex:
4.6.1.12;

Protein crystallography data

The structure of Ispf (Plasmodium Falciparum) Cdp Complex, PDB code: 4c81 was solved by P.E.F.O'rourke, J.Kalinowska-Tluscik, P.K.Fyfe, A.Dawson, W.N.Hunter, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 26.38 / 1.56
Space group H 3
Cell size a, b, c (Å), α, β, γ (°) 84.864, 84.864, 101.031, 90.00, 90.00, 120.00
R / Rfree (%) 14.398 / 16.503

Other elements in 4c81:

The structure of Ispf (Plasmodium Falciparum) Cdp Complex also contains other interesting chemical elements:

Chlorine (Cl) 3 atoms

Zinc Binding Sites:

The binding sites of Zinc atom in the Ispf (Plasmodium Falciparum) Cdp Complex (pdb code 4c81). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 2 binding sites of Zinc where determined in the Ispf (Plasmodium Falciparum) Cdp Complex, PDB code: 4c81:
Jump to Zinc binding site number: 1; 2;

Zinc binding site 1 out of 2 in 4c81

Go back to Zinc Binding Sites List in 4c81
Zinc binding site 1 out of 2 in the Ispf (Plasmodium Falciparum) Cdp Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Ispf (Plasmodium Falciparum) Cdp Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn1240

b:19.9
occ:1.00
O A:HOH2009 1.8 28.9 1.0
OD2 A:ASP71 2.0 24.6 1.0
NE2 A:HIS73 2.0 21.6 1.0
ND1 A:HIS123 2.1 21.9 1.0
CG A:ASP71 2.8 19.6 1.0
CD2 A:HIS73 3.0 16.2 1.0
OD1 A:ASP71 3.0 18.6 1.0
CE1 A:HIS123 3.0 22.8 1.0
CE1 A:HIS73 3.0 17.9 1.0
CG A:HIS123 3.1 15.2 1.0
CB A:HIS123 3.4 21.2 1.0
O1B A:CDP1242 3.6 30.8 0.6
ND1 A:HIS73 4.1 19.8 1.0
CG A:HIS73 4.1 17.8 1.0
NE2 A:HIS123 4.1 23.6 1.0
CD2 A:HIS123 4.2 22.9 1.0
CB A:ASP71 4.2 13.6 1.0
O A:HOH2008 4.5 31.1 1.0
OG A:SER116 4.5 36.8 1.0
O A:ASP119 4.7 18.1 1.0
CA A:ILE120 4.9 18.0 1.0
C A:ASP119 4.9 16.3 1.0
CA A:HIS123 4.9 17.4 1.0
O A:ILE72 5.0 18.7 1.0

Zinc binding site 2 out of 2 in 4c81

Go back to Zinc Binding Sites List in 4c81
Zinc binding site 2 out of 2 in the Ispf (Plasmodium Falciparum) Cdp Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Ispf (Plasmodium Falciparum) Cdp Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn1241

b:26.1
occ:1.00
NE2 A:HIS215 2.1 18.9 1.0
CL A:CL1244 2.2 30.0 1.0
CL A:CL1246 2.3 44.0 1.0
CE1 A:HIS215 3.0 23.7 1.0
CD2 A:HIS215 3.1 18.6 1.0
ND1 A:HIS215 4.1 17.3 1.0
CG A:HIS215 4.2 19.4 1.0
O A:HOH2085 4.5 27.2 1.0
O A:HOH2073 5.0 22.8 1.0

Reference:

P.E.O Rourke, J.Kalinowska-Tluscik, P.K.Fyfe, A.Dawson, W.N.Hunter. Crystal Structures of Ispf From Plasmodium Falciparum and Burkholderia Cenocepacia: Comparisons Inform Antimicrobial Drug Target Assessment. Bmc Struct.Biol. V. 14 1 2014.
ISSN: ISSN 1472-6807
PubMed: 24410837
DOI: 10.1186/1472-6807-14-1
Page generated: Sat Oct 26 20:39:57 2024

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