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Calcium in PDB 3hl0: Crystal Structure of Maleylacetate Reductase From Agrobacterium Tumefaciens

Protein crystallography data

The structure of Crystal Structure of Maleylacetate Reductase From Agrobacterium Tumefaciens, PDB code: 3hl0 was solved by C.Chang, E.Evdokimova, A.Mursleen, A.Savchenko, A.Edwards, A.Joachimiak, Midwest Center For Structural Genomics (Mcsg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 28.84 / 1.60
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 57.808, 120.611, 95.360, 90.00, 100.10, 90.00
R / Rfree (%) 16.3 / 18.9

Calcium Binding Sites:

The binding sites of Calcium atom in the Crystal Structure of Maleylacetate Reductase From Agrobacterium Tumefaciens (pdb code 3hl0). This binding sites where shown within 5.0 Angstroms radius around Calcium atom.
In total 2 binding sites of Calcium where determined in the Crystal Structure of Maleylacetate Reductase From Agrobacterium Tumefaciens, PDB code: 3hl0:
Jump to Calcium binding site number: 1; 2;

Calcium binding site 1 out of 2 in 3hl0

Go back to Calcium Binding Sites List in 3hl0
Calcium binding site 1 out of 2 in the Crystal Structure of Maleylacetate Reductase From Agrobacterium Tumefaciens


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 1 of Crystal Structure of Maleylacetate Reductase From Agrobacterium Tumefaciens within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca401

b:27.2
occ:1.00
O A:HOH412 2.2 19.7 1.0
O A:HOH636 2.3 17.3 1.0
O A:HOH352 2.4 34.0 1.0
OE2 A:GLU147 2.4 17.2 1.0
O A:HOH525 2.4 20.7 1.0
O A:HOH457 2.5 14.3 1.0
CD A:GLU147 3.5 15.2 1.0
OE1 A:GLU147 3.8 12.3 1.0
O A:GLU143 3.9 17.6 1.0
OD1 A:ASP109 4.1 29.9 1.0
O A:HOH476 4.2 24.2 1.0
O A:ALA110 4.3 14.1 1.0
C A:GLU143 4.4 16.8 1.0
CA A:GLU143 4.4 17.9 1.0
O A:LEU145 4.5 11.5 1.0
O A:PRO142 4.7 18.1 1.0
CG A:GLU147 4.8 12.0 1.0
CG A:ASP109 4.9 22.2 1.0
O A:ASP109 4.9 17.1 1.0
O A:HOH650 4.9 24.0 1.0

Calcium binding site 2 out of 2 in 3hl0

Go back to Calcium Binding Sites List in 3hl0
Calcium binding site 2 out of 2 in the Crystal Structure of Maleylacetate Reductase From Agrobacterium Tumefaciens


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 2 of Crystal Structure of Maleylacetate Reductase From Agrobacterium Tumefaciens within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca401

b:23.1
occ:1.00
O B:HOH561 2.3 24.8 1.0
O B:HOH446 2.3 15.4 1.0
O B:HOH570 2.3 19.1 1.0
OE2 B:GLU147 2.4 17.2 1.0
O B:HOH443 2.4 17.9 1.0
O B:HOH362 2.5 11.2 1.0
O B:GLU143 3.3 19.6 1.0
CD B:GLU147 3.5 16.3 1.0
OE1 B:GLU147 3.8 12.2 1.0
C B:GLU143 4.1 17.5 1.0
O B:ALA110 4.2 11.2 1.0
OD1 B:ASP109 4.3 18.1 0.5
CA B:GLU143 4.3 18.2 1.0
O B:HOH500 4.5 30.6 1.0
O B:HOH477 4.5 35.3 1.0
O B:LEU145 4.5 11.8 1.0
O B:ASP109 4.7 11.6 0.5
CG B:GLU147 4.8 13.6 1.0
O B:PRO142 4.8 18.8 1.0
CB B:GLU143 4.9 19.2 1.0

Reference:

C.Chang, E.Evdokimova, A.Mursleen, A.Savchenko, A.Edwards, A.Joachimiak. Crystal Structure of Maleylacetate Reductase From Agrobacterium Tumefaciens To Be Published.
Page generated: Sat Jul 13 11:04:49 2024

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