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Magnesium in PDB 1s1c: Crystal Structure of the Complex Between the Human Rhoa and Rho-Binding Domain of Human Rocki

Protein crystallography data

The structure of Crystal Structure of the Complex Between the Human Rhoa and Rho-Binding Domain of Human Rocki, PDB code: 1s1c was solved by R.Dvorsky, L.Blumenstein, I.R.Vetter, M.R.Ahmadian, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 19.77 / 2.60
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 34.404, 89.537, 98.105, 90.00, 91.86, 90.00
R / Rfree (%) 21.9 / 25.7

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Crystal Structure of the Complex Between the Human Rhoa and Rho-Binding Domain of Human Rocki (pdb code 1s1c). 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 Complex Between the Human Rhoa and Rho-Binding Domain of Human Rocki, PDB code: 1s1c:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in 1s1c

Go back to Magnesium Binding Sites List in 1s1c
Magnesium binding site 1 out of 2 in the Crystal Structure of the Complex Between the Human Rhoa and Rho-Binding Domain of Human Rocki


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 Complex Between the Human Rhoa and Rho-Binding Domain of Human Rocki within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg300

b:24.5
occ:1.00
O2G A:GNP200 2.2 22.6 1.0
O A:HOH301 2.2 17.7 1.0
OG1 A:THR19 2.3 18.4 1.0
O2B A:GNP200 2.3 17.8 1.0
OG1 A:THR37 2.4 28.7 1.0
O A:HOH314 2.4 17.0 1.0
CB A:THR37 3.1 25.9 1.0
PG A:GNP200 3.2 22.9 1.0
N3B A:GNP200 3.2 21.1 1.0
PB A:GNP200 3.2 18.3 1.0
CB A:THR19 3.3 21.0 1.0
N A:THR37 3.8 25.1 1.0
CA A:THR37 4.1 26.5 1.0
O2A A:GNP200 4.1 21.1 1.0
O3G A:GNP200 4.1 22.1 1.0
N A:THR19 4.1 19.4 1.0
O1G A:GNP200 4.2 22.2 1.0
O3A A:GNP200 4.2 19.7 1.0
CG2 A:THR37 4.3 24.3 1.0
CA A:THR19 4.3 19.6 1.0
OD2 A:ASP59 4.3 26.2 1.0
CG2 A:THR19 4.3 18.9 1.0
OD1 A:ASP59 4.3 22.6 1.0
O1B A:GNP200 4.3 20.7 1.0
O A:VAL35 4.4 25.9 1.0
O A:HOH317 4.5 24.3 1.0
PA A:GNP200 4.5 20.6 1.0
CG A:ASP59 4.7 24.1 1.0
O A:THR60 4.7 21.0 1.0
C A:PRO36 4.8 25.5 1.0
O1A A:GNP200 4.8 20.4 1.0

Magnesium binding site 2 out of 2 in 1s1c

Go back to Magnesium Binding Sites List in 1s1c
Magnesium binding site 2 out of 2 in the Crystal Structure of the Complex Between the Human Rhoa and Rho-Binding Domain of Human Rocki


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 Complex Between the Human Rhoa and Rho-Binding Domain of Human Rocki within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg1300

b:30.3
occ:1.00
OG1 B:THR37 2.3 31.4 1.0
O B:HOH1301 2.3 24.1 1.0
O2G B:GNP1200 2.3 30.6 1.0
O B:HOH1313 2.4 24.5 1.0
OG1 B:THR19 2.4 20.8 1.0
O2B B:GNP1200 2.4 22.9 1.0
CB B:THR37 3.2 28.9 1.0
N3B B:GNP1200 3.2 26.8 1.0
PG B:GNP1200 3.2 26.1 1.0
CB B:THR19 3.3 21.1 1.0
PB B:GNP1200 3.3 24.7 1.0
N B:THR37 3.7 32.5 1.0
O2A B:GNP1200 3.8 29.6 1.0
CA B:THR37 4.0 30.2 1.0
O B:VAL35 4.1 36.4 1.0
O1G B:GNP1200 4.2 24.4 1.0
O3A B:GNP1200 4.2 27.5 1.0
CG2 B:THR19 4.2 17.4 1.0
O3G B:GNP1200 4.3 23.3 1.0
N B:THR19 4.3 22.1 1.0
PA B:GNP1200 4.4 28.9 1.0
CG2 B:THR37 4.4 26.3 1.0
CA B:THR19 4.4 21.3 1.0
O1B B:GNP1200 4.5 26.4 1.0
OD2 B:ASP59 4.5 21.3 1.0
C B:PRO36 4.6 33.0 1.0
OD1 B:ASP59 4.6 18.2 1.0
O1A B:GNP1200 4.7 28.9 1.0
CE1 B:TYR34 4.8 45.8 1.0
CA B:PRO36 5.0 33.6 1.0
CG B:ASP59 5.0 22.1 1.0

Reference:

R.Dvorsky, L.Blumenstein, I.R.Vetter, M.R.Ahmadian. Structural Insights Into the Interaction of Rocki with the Switch Regions of Rhoa. J.Biol.Chem. V. 279 7098 2004.
ISSN: ISSN 0021-9258
PubMed: 14660612
DOI: 10.1074/JBC.M311911200
Page generated: Tue Aug 13 13:13:44 2024

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