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Calcium in PDB 3lbi: Ras Soaked in Magnesium Acetate and Back Soaked in Calcium Acetate

Protein crystallography data

The structure of Ras Soaked in Magnesium Acetate and Back Soaked in Calcium Acetate, PDB code: 3lbi was solved by G.Holzapfel, G.Buhrman, C.Mattos, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 25.40 / 2.09
Space group H 3 2
Cell size a, b, c (Å), α, β, γ (°) 88.716, 88.716, 134.583, 90.00, 90.00, 120.00
R / Rfree (%) 17.5 / 21.7

Other elements in 3lbi:

The structure of Ras Soaked in Magnesium Acetate and Back Soaked in Calcium Acetate also contains other interesting chemical elements:

Magnesium (Mg) 2 atoms

Calcium Binding Sites:

The binding sites of Calcium atom in the Ras Soaked in Magnesium Acetate and Back Soaked in Calcium Acetate (pdb code 3lbi). This binding sites where shown within 5.0 Angstroms radius around Calcium atom.
In total 2 binding sites of Calcium where determined in the Ras Soaked in Magnesium Acetate and Back Soaked in Calcium Acetate, PDB code: 3lbi:
Jump to Calcium binding site number: 1; 2;

Calcium binding site 1 out of 2 in 3lbi

Go back to Calcium Binding Sites List in 3lbi
Calcium binding site 1 out of 2 in the Ras Soaked in Magnesium Acetate and Back Soaked in Calcium Acetate


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 1 of Ras Soaked in Magnesium Acetate and Back Soaked in Calcium Acetate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca167

b:26.8
occ:1.00
O A:PHE28 2.4 26.4 1.0
OD1 A:ASP30 2.5 29.4 1.0
O A:HOH244 2.5 32.0 1.0
O A:HOH274 2.6 37.5 1.0
C A:PHE28 3.6 25.2 1.0
CG A:ASP30 3.7 29.3 1.0
N A:ASP30 4.0 24.9 1.0
CA A:VAL29 4.3 22.9 1.0
O A:HOH252 4.4 42.3 1.0
N A:VAL29 4.4 25.0 1.0
O A:HOH217 4.5 31.5 1.0
CB A:ASP30 4.5 25.2 1.0
OD2 A:ASP30 4.6 30.1 1.0
CA A:PHE28 4.6 23.9 1.0
C A:VAL29 4.7 25.0 1.0
N A:PHE28 4.8 21.7 1.0
CA A:ASP30 4.9 26.1 1.0
CB A:PHE28 4.9 29.9 1.0

Calcium binding site 2 out of 2 in 3lbi

Go back to Calcium Binding Sites List in 3lbi
Calcium binding site 2 out of 2 in the Ras Soaked in Magnesium Acetate and Back Soaked in Calcium Acetate


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 2 of Ras Soaked in Magnesium Acetate and Back Soaked in Calcium Acetate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca169

b:47.1
occ:1.00
O A:ASP107 2.6 42.6 1.0
O A:HOH262 2.6 32.4 1.0
O A:TYR137 2.6 26.9 1.0
O A:ACT719 2.7 36.7 1.0
OXT A:ACT719 2.7 36.9 1.0
O A:HOH293 2.7 37.4 1.0
C A:ACT719 3.1 41.1 1.0
C A:ASP107 3.4 40.4 1.0
C A:TYR137 3.7 27.5 1.0
CA A:ASP108 4.1 38.6 1.0
N A:ASP108 4.2 39.1 1.0
CA A:TYR137 4.2 26.0 1.0
CA A:ASP107 4.2 43.1 1.0
NH2 A:ARG97 4.3 34.6 1.0
CB A:TYR137 4.5 28.2 1.0
CB A:ASP107 4.5 45.8 1.0
N A:VAL109 4.6 32.9 1.0
CH3 A:ACT719 4.6 33.5 1.0
CE A:MET111 4.7 25.8 1.0
OD1 A:ASP108 4.7 51.9 1.0
O A:HOH288 4.7 31.4 1.0
N A:GLY138 4.7 26.1 1.0
OD2 A:ASP107 4.8 50.2 1.0
CG A:ASP107 4.8 51.8 1.0
C A:ASP108 4.8 36.3 1.0
O A:VAL109 4.8 24.1 1.0
CG2 A:ILE139 4.8 19.6 1.0
NE A:ARG97 5.0 34.8 1.0

Reference:

G.Buhrman, G.Holzapfel, S.Fetics, C.Mattos. Allosteric Modulation of Ras Positions Q61 For A Direct Role in Catalysis. Proc.Natl.Acad.Sci.Usa V. 107 4931 2010.
ISSN: ISSN 0027-8424
PubMed: 20194776
DOI: 10.1073/PNAS.0912226107
Page generated: Sat Jul 13 12:58:37 2024

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