Magnesium in PDB 3q0g: Crystal Structure of the Mycobacterium Tuberculosis Crotonase Bound to A Reaction Intermediate Derived From Crotonyl Coa

All present enzymatic activity of Crystal Structure of the Mycobacterium Tuberculosis Crotonase Bound to A Reaction Intermediate Derived From Crotonyl Coa:
4.2.1.17;

The structure of Crystal Structure of the Mycobacterium Tuberculosis Crotonase Bound to A Reaction Intermediate Derived From Crotonyl Coa, PDB code: 3q0g was solved by J.B.Bruning, E.Delgado, S.Ghosh, J.C.Sacchettini, Tb Structural Genomicsconsortium (Tbsgc), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	19.87 / 2.38
Space group	P 21 21 2
Cell size a, b, c (Å), α, β, γ (°)	101.640, 133.170, 133.690, 90.00, 90.00, 90.00
R / Rfree (%)	23.3 / 28.8

The binding sites of Magnesium atom in the Crystal Structure of the Mycobacterium Tuberculosis Crotonase Bound to A Reaction Intermediate Derived From Crotonyl Coa (pdb code 3q0g). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Crystal Structure of the Mycobacterium Tuberculosis Crotonase Bound to A Reaction Intermediate Derived From Crotonyl Coa, PDB code: 3q0g:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in the Crystal Structure of the Mycobacterium Tuberculosis Crotonase Bound to A Reaction Intermediate Derived From Crotonyl Coa


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Crystal Structure of the Mycobacterium Tuberculosis Crotonase Bound to A Reaction Intermediate Derived From Crotonyl Coa within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg258 b:61.6 occ:1.00 O4A C:COA258 3.1 38.7 1.0 O6A C:COA258 4.1 40.6 1.0 P2A C:COA258 4.2 40.3 1.0 CAP C:COA258 4.4 42.0 1.0 CDP C:COA258 4.5 41.6 1.0 O2A C:COA258 4.6 40.6 1.0 CCP C:COA258 4.6 41.0 1.0 O A:HOH594 4.7 25.3 1.0 CBP C:COA258 4.8 41.8 1.0 OAP C:COA258 5.0 42.2 1.0

Magnesium binding site 2 out of 2 in the Crystal Structure of the Mycobacterium Tuberculosis Crotonase Bound to A Reaction Intermediate Derived From Crotonyl Coa


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Crystal Structure of the Mycobacterium Tuberculosis Crotonase Bound to A Reaction Intermediate Derived From Crotonyl Coa within 5.0Å range: probe atom residue distance (Å) B Occ F:Mg258 b:61.6 occ:1.00 O12 F:BCO259 2.6 43.3 1.0 O4 F:BCO259 3.0 42.5 1.0 O F:HOH610 3.2 22.7 1.0 P2 F:BCO259 3.5 42.7 1.0 O F:HOH635 3.7 24.6 1.0 C5 F:BCO259 3.8 40.8 1.0 O7 F:BCO259 4.0 40.2 1.0 C3 F:BCO259 4.5 39.4 1.0 O10 F:BCO259 4.8 40.6 1.0 P3 F:BCO259 4.8 40.3 1.0 O13 F:BCO259 4.8 38.3 1.0

J.B.Bruning, E.Delgado, S.Ghosh, J.C.Sacchettini. Crystal Structure of the Prokaryotic Crotonase To Be Published.