Magnesium in PDB 4cc7: Crystal Structure of the Sixth or C-Terminal SH3 Domain of Human Tuba in Complex with Proline-Rich Peptides of N-Wasp. Space Group P41

The structure of Crystal Structure of the Sixth or C-Terminal SH3 Domain of Human Tuba in Complex with Proline-Rich Peptides of N-Wasp. Space Group P41, PDB code: 4cc7 was solved by L.Polle, L.Rigano, R.Julian, K.Ireton, W.-D.Schubert, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	46.59 / 1.97
Space group	P 41
Cell size a, b, c (Å), α, β, γ (°)	88.570, 88.570, 69.730, 90.00, 90.00, 90.00
R / Rfree (%)	17.61 / 21.459

The structure of Crystal Structure of the Sixth or C-Terminal SH3 Domain of Human Tuba in Complex with Proline-Rich Peptides of N-Wasp. Space Group P41 also contains other interesting chemical elements:

Chlorine

(Cl)

17 atoms

The binding sites of Magnesium atom in the Crystal Structure of the Sixth or C-Terminal SH3 Domain of Human Tuba in Complex with Proline-Rich Peptides of N-Wasp. Space Group P41 (pdb code 4cc7). 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 Sixth or C-Terminal SH3 Domain of Human Tuba in Complex with Proline-Rich Peptides of N-Wasp. Space Group P41, PDB code: 4cc7:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in the Crystal Structure of the Sixth or C-Terminal SH3 Domain of Human Tuba in Complex with Proline-Rich Peptides of N-Wasp. Space Group P41


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 Sixth or C-Terminal SH3 Domain of Human Tuba in Complex with Proline-Rich Peptides of N-Wasp. Space Group P41 within 5.0Å range: probe atom residue distance (Å) B Occ K:Mg2577 b:48.1 occ:1.00 O K:PRO1529 2.3 31.1 1.0 O C:HOH2029 2.3 40.4 1.0 O C:HOH2030 2.5 45.6 1.0 O K:HOH2011 2.5 47.2 1.0 O K:HOH2026 2.6 42.8 0.5 O K:HOH2010 2.6 44.9 0.7 C K:PRO1529 3.5 30.9 1.0 NZ K:LYS1562 3.8 59.5 0.7 O K:HOH2008 4.0 38.4 1.0 O K:LYS1563 4.3 28.6 1.0 CA K:PRO1529 4.3 31.8 1.0 O K:GLU1531 4.4 23.0 1.0 N K:ASN1530 4.4 29.0 1.0 CA K:ASN1530 4.4 26.9 1.0 O C:VAL1548 4.7 27.9 1.0 O K:HOH2027 4.8 36.9 1.0 CA C:THR1549 4.8 29.2 1.0 CB K:PRO1529 4.8 37.1 1.0 C K:ASN1530 4.9 25.0 1.0

Magnesium binding site 2 out of 2 in the Crystal Structure of the Sixth or C-Terminal SH3 Domain of Human Tuba in Complex with Proline-Rich Peptides of N-Wasp. Space Group P41


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 Sixth or C-Terminal SH3 Domain of Human Tuba in Complex with Proline-Rich Peptides of N-Wasp. Space Group P41 within 5.0Å range: probe atom residue distance (Å) B Occ M:Mg2577 b:53.0 occ:1.00 O M:HOH2011 2.4 46.8 1.0 O M:PRO1529 2.5 34.4 1.0 O M:HOH2012 2.5 42.5 1.0 O M:HOH2013 3.2 52.1 1.0 NZ M:LYS1562 3.5 64.3 1.0 C M:PRO1529 3.6 34.5 1.0 CA M:PRO1529 4.1 34.0 1.0 O M:HOH2008 4.3 33.0 1.0 O M:LYS1563 4.4 34.3 1.0 CB M:PRO1529 4.4 37.6 1.0 O M:GLU1531 4.5 30.1 1.0 N M:ASN1530 4.7 33.6 1.0

L.Polle, L.A.Rigano, R.Julian, K.Ireton, W.Schubert. Structural Details of Human Tuba Recruitment By Inlc of Listeria Monocytogenes Elucidate Bacterial Cell-Cell Spreading. Structure V. 22 304 2014.
ISSN: ISSN 0969-2126
PubMed: 24332715
DOI: 10.1016/J.STR.2013.10.017