Magnesium in PDB 8bzw: Co-Soaked Stabilizers For Era - 14-3-3 Interaction (844_AZ210)

The structure of Co-Soaked Stabilizers For Era - 14-3-3 Interaction (844_AZ210), PDB code: 8bzw was solved by E.J.Visser, E.Sijbesma, C.Ottmann, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	45.34 / 1.10
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	81.806, 112.014, 62.335, 90, 90, 90
R / Rfree (%)	17.8 / 19.3

The structure of Co-Soaked Stabilizers For Era - 14-3-3 Interaction (844_AZ210) also contains other interesting chemical elements:

Chlorine

(Cl)

1 atom

The binding sites of Magnesium atom in the Co-Soaked Stabilizers For Era - 14-3-3 Interaction (844_AZ210) (pdb code 8bzw). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 3 binding sites of Magnesium where determined in the Co-Soaked Stabilizers For Era - 14-3-3 Interaction (844_AZ210), PDB code: 8bzw:
Jump to Magnesium binding site number: 1; 2; 3;

Magnesium binding site 1 out of 3 in the Co-Soaked Stabilizers For Era - 14-3-3 Interaction (844_AZ210)


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Co-Soaked Stabilizers For Era - 14-3-3 Interaction (844_AZ210) within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg301 b:27.9 occ:1.00 O A:HOH462 2.7 11.7 1.0 O A:HOH710 3.2 26.1 1.0 O A:HOH649 3.3 19.6 1.0 HZ3 A:LYS159 3.6 36.9 1.0 O A:HOH588 3.7 22.6 1.0 HZ2 A:LYS159 4.0 36.9 1.0 O A:HOH420 4.2 31.9 1.0 NZ A:LYS159 4.2 30.7 1.0 O A:HOH523 4.4 15.6 1.0 OE2 A:GLU189 4.5 11.3 1.0 O A:HOH684 4.6 28.0 1.0 HZ1 A:LYS159 4.6 36.9 1.0 HE22 A:GLN152 4.8 17.2 1.0 O A:HOH542 5.0 24.5 1.0

Magnesium binding site 2 out of 3 in the Co-Soaked Stabilizers For Era - 14-3-3 Interaction (844_AZ210)


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Co-Soaked Stabilizers For Era - 14-3-3 Interaction (844_AZ210) within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg302 b:44.1 occ:1.00 O A:HOH653 4.1 23.5 1.0 O A:HOH410 4.5 4.9 0.5 O A:HOH405 4.6 30.6 1.0

Magnesium binding site 3 out of 3 in the Co-Soaked Stabilizers For Era - 14-3-3 Interaction (844_AZ210)


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 3 of Co-Soaked Stabilizers For Era - 14-3-3 Interaction (844_AZ210) within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg303 b:18.1 occ:1.00 O A:HOH461 2.1 24.7 1.0 O A:HOH592 2.3 34.4 1.0 O A:HOH668 2.3 30.0 1.0 OE2 A:GLU89 2.4 16.2 1.0 CD A:GLU89 3.5 11.5 1.0 HG2 A:GLU86 3.6 17.5 1.0 HG2 A:GLU89 3.8 13.5 1.0 O A:HOH557 3.9 29.8 1.0 HH12 A:ARG85 4.0 17.1 1.0 HE22 A:GLN93 4.0 16.6 1.0 CG A:GLU89 4.2 11.2 1.0 HB3 A:GLU89 4.3 12.8 1.0 O A:HOH594 4.3 28.7 1.0 OE1 A:GLU89 4.4 11.9 1.0 HH11 A:ARG85 4.4 17.1 1.0 OE1 A:GLN93 4.5 12.7 1.0 CG A:GLU86 4.5 14.6 1.0 HA A:GLU86 4.5 12.8 1.0 NH1 A:ARG85 4.5 14.2 1.0 O A:HOH650 4.6 29.0 1.0 HG1 A:THR90 4.6 18.2 1.0 NE2 A:GLN93 4.7 13.8 1.0 CB A:GLU89 4.8 10.7 1.0 OG1 A:THR90 4.9 15.1 1.0 HG3 A:GLU86 4.9 17.5 1.0 HB3 A:GLU86 4.9 13.8 1.0 CD A:GLN93 5.0 11.6 1.0 HG3 A:GLU89 5.0 13.5 1.0

E.J.Visser, P.Jaishankar, E.Sijbesma, M.A.M.Pennings, E.M.F.Vandenboorn, X.Guillory, R.J.Neitz, J.Morrow, S.Dutta, A.R.Renslo, L.Brunsveld, M.R.Arkin, C.Ottmann. From Tethered to Freestanding Stabilizers of 14-3-3 Protein-Protein Interactions Via Fragment Linking. Angew.Chem.Int.Ed.Engl. 08004 2023.
ISSN: ESSN 1521-3773
PubMed: 37455289
DOI: 10.1002/ANIE.202308004