Magnesium in PDB 9g5n: Xylose Isomerase Collected at 20C Using Serial Fixed-Target Crystallography

All present enzymatic activity of Xylose Isomerase Collected at 20C Using Serial Fixed-Target Crystallography:
5.3.1.5;

The structure of Xylose Isomerase Collected at 20C Using Serial Fixed-Target Crystallography, PDB code: 9g5n was solved by E.C.Schulz, A.Prester, D.V.Stetten, G.Gore, C.E.Hatton, K.Bartels, J.P.Leimkohl, H.Schikora, H.M.Ginn, F.Tellkamp, P.Mehrabi, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	71.49 / 1.70
Space group	I 2 2 2
Cell size a, b, c (Å), α, β, γ (°)	94.2, 103.05, 99.25, 90, 90, 90
R / Rfree (%)	16.2 / 19.1

The binding sites of Magnesium atom in the Xylose Isomerase Collected at 20C Using Serial Fixed-Target Crystallography (pdb code 9g5n). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Xylose Isomerase Collected at 20C Using Serial Fixed-Target Crystallography, PDB code: 9g5n:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in the Xylose Isomerase Collected at 20C Using Serial Fixed-Target Crystallography


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Xylose Isomerase Collected at 20C Using Serial Fixed-Target Crystallography within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg401 b:22.7 occ:1.00 OE2 A:GLU181 1.9 16.8 1.0 OD2 A:ASP287 1.9 13.1 1.0 OE1 A:GLU217 2.1 10.8 1.0 OD2 A:ASP245 2.2 10.8 1.0 O A:HOH506 2.3 41.1 1.0 CD A:GLU181 2.9 17.1 1.0 CG A:ASP287 3.0 12.8 1.0 O A:HOH669 3.1 35.2 1.0 OE1 A:GLU181 3.3 17.6 1.0 CG A:ASP245 3.3 10.8 1.0 CD A:GLU217 3.4 8.6 1.0 O A:HOH614 3.4 41.8 1.0 CB A:ASP287 3.5 10.1 1.0 O A:HOH722 3.6 13.9 1.0 O A:HOH667 3.7 21.6 1.0 CB A:ASP245 3.9 9.9 1.0 OD1 A:ASP287 4.1 11.2 1.0 CG A:GLU181 4.1 12.0 1.0 CE1 A:HIS220 4.1 11.5 1.0 CB A:GLU217 4.2 7.6 1.0 CG A:GLU217 4.2 7.2 1.0 OE2 A:GLU217 4.3 9.5 1.0 OD1 A:ASP245 4.3 10.1 1.0 NE2 A:HIS220 4.7 12.8 1.0 O A:HOH535 4.9 47.5 1.0 ND1 A:HIS220 4.9 8.8 1.0 ND2 A:ASN215 4.9 11.7 1.0 MG A:MG402 5.0 9.3 1.0

Magnesium binding site 2 out of 2 in the Xylose Isomerase Collected at 20C Using Serial Fixed-Target Crystallography


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Xylose Isomerase Collected at 20C Using Serial Fixed-Target Crystallography within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg402 b:9.3 occ:1.00 OE2 A:GLU217 2.0 9.5 1.0 OD2 A:ASP255 2.1 12.8 1.0 O A:HOH722 2.1 13.9 1.0 OD1 A:ASP257 2.2 12.9 1.0 OD1 A:ASP255 2.2 10.0 1.0 NE2 A:HIS220 2.4 12.8 1.0 CG A:ASP255 2.5 12.9 1.0 CD A:GLU217 3.0 8.6 1.0 CD2 A:HIS220 3.1 9.5 1.0 CG A:ASP257 3.1 11.4 1.0 OD2 A:ASP257 3.4 16.8 1.0 OE1 A:GLU217 3.4 10.8 1.0 CE1 A:HIS220 3.5 11.5 1.0 O A:HOH770 3.8 18.6 1.0 ND2 A:ASN247 4.0 9.8 1.0 CB A:ASP255 4.0 7.5 1.0 O A:HOH588 4.0 9.7 1.0 O A:HOH535 4.3 47.5 1.0 CG A:HIS220 4.3 6.2 1.0 CG A:GLU217 4.3 7.2 1.0 ND1 A:HIS220 4.4 8.8 1.0 O A:HOH675 4.5 28.2 1.0 CB A:ASP257 4.5 6.4 1.0 O A:HOH669 4.6 35.2 1.0 CE A:LYS183 4.8 10.4 1.0 CA A:ASP257 4.9 6.9 1.0 NZ A:LYS183 4.9 13.3 1.0 N A:ASP257 5.0 8.0 1.0 CA A:ASP255 5.0 6.3 1.0 MG A:MG401 5.0 22.7 1.0 OD2 A:ASP287 5.0 13.1 1.0

E.C.Schulz, A.Prester, D.V.Stetten, G.Gore, C.E.Hatton, K.Bartels, J.P.Leimkohl, H.Schikora, H.M.Ginn, F.Tellkamp, P.Mehrabi. Xylose Isomerase Collected at 20C Using Serial Fixed-Target Crystallography To Be Published.