Magnesium in PDB 1j1c: Binary Complex Structure of Human Tau Protein Kinase I with Adp

All present enzymatic activity of Binary Complex Structure of Human Tau Protein Kinase I with Adp:
2.7.1.37;

The structure of Binary Complex Structure of Human Tau Protein Kinase I with Adp, PDB code: 1j1c was solved by M.Aoki, T.Yokota, I.Sugiura, C.Sasaki, T.Hasegawa, C.Okumura, T.Kohno, S.Sugio, T.Matsuzaki, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	15.00 / 2.10
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	82.900, 86.100, 178.100, 90.00, 90.00, 90.00
R / Rfree (%)	21.8 / 24.2

The binding sites of Magnesium atom in the Binary Complex Structure of Human Tau Protein Kinase I with Adp (pdb code 1j1c). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Binary Complex Structure of Human Tau Protein Kinase I with Adp, PDB code: 1j1c:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in the Binary Complex Structure of Human Tau Protein Kinase I with Adp


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Binary Complex Structure of Human Tau Protein Kinase I with Adp within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg431 b:55.9 occ:1.00 O1B A:ADP430 2.4 60.0 1.0 OD1 A:ASN186 2.4 21.5 1.0 O2A A:ADP430 2.5 57.2 1.0 OD2 A:ASP200 2.6 28.2 1.0 CG A:ASN186 3.4 20.5 1.0 CG A:ASP200 3.6 26.3 1.0 O A:HOH556 3.7 54.2 1.0 ND2 A:ASN186 3.7 20.3 1.0 PB A:ADP430 3.9 61.1 1.0 PA A:ADP430 3.9 57.0 1.0 CE A:LYS183 4.0 20.9 1.0 CB A:ASP200 4.0 23.3 1.0 O3' A:ADP430 4.0 50.3 1.0 O3A A:ADP430 4.3 58.8 1.0 NZ A:LYS183 4.4 23.6 1.0 OD2 A:ASP181 4.6 24.1 1.0 OD1 A:ASP200 4.7 28.3 1.0 O2B A:ADP430 4.7 61.7 1.0 C5' A:ADP430 4.7 52.8 1.0 O5' A:ADP430 4.7 55.9 1.0 CB A:ASN186 4.8 20.6 1.0 O3B A:ADP430 4.8 60.7 1.0 C3' A:ADP430 4.8 49.8 1.0 O1A A:ADP430 4.9 56.0 1.0 O A:GLN185 5.0 21.6 1.0

Magnesium binding site 2 out of 2 in the Binary Complex Structure of Human Tau Protein Kinase I with Adp


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Binary Complex Structure of Human Tau Protein Kinase I with Adp within 5.0Å range: probe atom residue distance (Å) B Occ B:Mg931 b:48.0 occ:1.00 OD1 B:ASN686 2.4 24.4 1.0 O B:HOH122 2.4 40.8 1.0 O2A B:ADP930 2.4 47.9 1.0 O1B B:ADP930 2.4 51.1 1.0 OD2 B:ASP700 2.7 30.0 1.0 CG B:ASN686 3.3 22.2 1.0 ND2 B:ASN686 3.6 20.9 1.0 CG B:ASP700 3.7 28.7 1.0 PA B:ADP930 3.8 48.2 1.0 PB B:ADP930 3.8 52.5 1.0 CE B:LYS683 4.0 24.4 1.0 CB B:ASP700 4.1 25.6 1.0 O3' B:ADP930 4.1 41.6 1.0 O3A B:ADP930 4.2 49.7 1.0 C5' B:ADP930 4.3 43.6 1.0 NZ B:LYS683 4.3 27.5 1.0 O5' B:ADP930 4.5 47.0 1.0 O2B B:ADP930 4.6 52.7 1.0 CB B:ASN686 4.7 21.4 1.0 O B:GLN685 4.7 22.2 1.0 OD2 B:ASP681 4.7 26.4 1.0 OD1 B:ASP700 4.8 30.1 1.0 C3' B:ADP930 4.8 41.2 1.0 O3B B:ADP930 4.9 52.9 1.0 O1A B:ADP930 4.9 48.0 1.0 CA B:ASN686 4.9 21.9 1.0 C B:GLN685 4.9 23.1 1.0 CB B:GLN685 5.0 27.6 1.0

M.Aoki, T.Yokota, I.Sugiura, C.Sasaki, T.Hasegawa, C.Okumura, K.Ishiguro, T.Kohno, S.Sugio, T.Matsuzaki. Structural Insight Into Nucleotide Recognition in Tau-Protein Kinase I/Glycogen Synthase Kinase 3 Beta. Acta Crystallogr.,Sect.D V. 60 439 2004.
ISSN: ISSN 0907-4449
PubMed: 14993667
DOI: 10.1107/S090744490302938X