Magnesium in PDB 7zmf: Dehydratase Domain of Module 3 From Brevibacillus Brevis Orphan BGC11

The structure of Dehydratase Domain of Module 3 From Brevibacillus Brevis Orphan BGC11, PDB code: 7zmf was solved by Y.U.Tittes, D.A.Herbst, R.P.Jakob, T.Maier, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	48.68 / 2.21
Space group	P 21 21 2
Cell size a, b, c (Å), α, β, γ (°)	72.38, 197.36, 39.17, 90, 90, 90
R / Rfree (%)	22.4 / 24.6

The binding sites of Magnesium atom in the Dehydratase Domain of Module 3 From Brevibacillus Brevis Orphan BGC11 (pdb code 7zmf). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Dehydratase Domain of Module 3 From Brevibacillus Brevis Orphan BGC11, PDB code: 7zmf:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in the Dehydratase Domain of Module 3 From Brevibacillus Brevis Orphan BGC11


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Dehydratase Domain of Module 3 From Brevibacillus Brevis Orphan BGC11 within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg1501 b:111.4 occ:1.00 OE1 A:GLU1155 2.0 70.6 1.0 O A:HOH1621 2.1 65.7 1.0 OE1 A:GLU1232 2.1 60.5 1.0 OE2 A:GLU1232 2.2 58.5 1.0 OE2 A:GLU1155 2.2 81.4 1.0 CD A:GLU1155 2.3 70.1 1.0 CD A:GLU1232 2.4 58.5 1.0 HH21 A:ARG1157 2.9 68.3 1.0 HH A:TYR1234 3.5 72.2 1.0 CG A:GLU1155 3.7 61.8 1.0 NH2 A:ARG1157 3.7 56.9 1.0 HG2 A:GLU1155 3.8 74.1 1.0 CG A:GLU1232 3.9 54.1 1.0 HE A:ARG1157 4.0 61.8 1.0 HE1 A:TYR1234 4.1 73.3 1.0 HH22 A:ARG1157 4.1 68.3 1.0 HH A:TYR1246 4.1 60.4 1.0 HG2 A:GLU1232 4.1 64.9 1.0 O A:HOH1625 4.2 69.5 1.0 HB2 A:GLU1155 4.2 62.0 1.0 HG3 A:GLU1155 4.3 74.1 1.0 OH A:TYR1234 4.3 60.1 1.0 HG3 A:GLU1232 4.4 64.9 1.0 CB A:GLU1155 4.4 51.7 1.0 HB3 A:GLU1232 4.5 60.9 1.0 HB3 A:GLU1155 4.5 62.0 1.0 OH A:TYR1246 4.6 50.3 1.0 CZ A:ARG1157 4.7 51.1 1.0 NE A:ARG1157 4.7 51.5 1.0 CB A:GLU1232 4.7 50.7 1.0 HE1 A:TYR1246 4.8 52.2 1.0 HB2 A:GLU1232 4.8 60.9 1.0 CE1 A:TYR1234 4.9 61.1 1.0

Magnesium binding site 2 out of 2 in the Dehydratase Domain of Module 3 From Brevibacillus Brevis Orphan BGC11


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Dehydratase Domain of Module 3 From Brevibacillus Brevis Orphan BGC11 within 5.0Å range: probe atom residue distance (Å) B Occ B:Mg1501 b:69.1 occ:1.00 O B:HOH1614 2.0 55.6 1.0 OE1 B:GLU1155 2.1 55.9 1.0 OE1 B:GLU1232 2.1 45.1 1.0 OE2 B:GLU1232 2.2 47.9 1.0 OE2 B:GLU1155 2.3 67.0 1.0 CD B:GLU1155 2.4 57.3 1.0 CD B:GLU1232 2.5 43.0 1.0 HH21 B:ARG1157 3.2 56.4 1.0 HH B:TYR1234 3.4 57.2 1.0 CG B:GLU1155 3.8 52.1 1.0 CG B:GLU1232 4.0 42.5 1.0 HE1 B:TYR1234 4.0 53.7 1.0 HG2 B:GLU1155 4.0 62.5 1.0 NH2 B:ARG1157 4.1 47.0 1.0 HH B:TYR1246 4.2 51.9 1.0 OH B:TYR1234 4.2 47.7 1.0 HG2 B:GLU1232 4.3 51.0 1.0 HB2 B:GLU1155 4.3 58.9 1.0 HE B:ARG1157 4.3 49.3 1.0 HH22 B:ARG1157 4.4 56.4 1.0 HG3 B:GLU1155 4.4 62.5 1.0 HG3 B:GLU1232 4.4 51.0 1.0 HB3 B:GLU1232 4.6 48.5 1.0 CB B:GLU1155 4.6 49.1 1.0 OH B:TYR1246 4.6 43.2 1.0 HB3 B:GLU1155 4.7 58.9 1.0 CB B:GLU1232 4.8 40.4 1.0 CE1 B:TYR1234 4.8 44.8 1.0 HE2 B:MET1154 4.8 88.8 1.0 HB2 B:GLU1232 4.8 48.5 1.0 HE1 B:TYR1246 4.9 52.3 1.0

Y.U.Tittes, D.A.Herbst, R.P.Jakob, T.Maier. Dehydratase Domain of Module 3 From Brevibacillus Brevis Orphan BGC11 To Be Published.