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Calcium in PDB 8f8l: The Structure of RV2173 From M. Tuberculosis with Dmap Bound

Enzymatic activity of The Structure of RV2173 From M. Tuberculosis with Dmap Bound

All present enzymatic activity of The Structure of RV2173 From M. Tuberculosis with Dmap Bound:
2.5.1.1; 2.5.1.10;

Protein crystallography data

The structure of The Structure of RV2173 From M. Tuberculosis with Dmap Bound, PDB code: 8f8l was solved by J.M.Johnston, T.M.Allison, J.Titterington, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 19.58 / 2.20
Space group I 2 2 2
Cell size a, b, c (Å), α, β, γ (°) 66.841, 83.844, 188.122, 90, 90, 90
R / Rfree (%) 21.1 / 24.4

Calcium Binding Sites:

The binding sites of Calcium atom in the The Structure of RV2173 From M. Tuberculosis with Dmap Bound (pdb code 8f8l). This binding sites where shown within 5.0 Angstroms radius around Calcium atom.
In total 2 binding sites of Calcium where determined in the The Structure of RV2173 From M. Tuberculosis with Dmap Bound, PDB code: 8f8l:
Jump to Calcium binding site number: 1; 2;

Calcium binding site 1 out of 2 in 8f8l

Go back to Calcium Binding Sites List in 8f8l
Calcium binding site 1 out of 2 in the The Structure of RV2173 From M. Tuberculosis with Dmap Bound


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 1 of The Structure of RV2173 From M. Tuberculosis with Dmap Bound within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca403

b:45.7
occ:1.00
O1A A:DMA401 2.2 53.0 1.0
OD1 A:ASP84 2.4 35.6 1.0
O A:HOH621 2.4 46.0 1.0
OD2 A:ASP88 2.4 42.3 1.0
O A:HOH608 2.5 52.6 1.0
OD1 A:ASP88 2.9 40.5 1.0
CG A:ASP88 3.0 30.4 1.0
CG A:ASP84 3.4 31.6 1.0
PA A:DMA401 3.5 48.6 1.0
O A:HOH615 3.5 51.6 1.0
OD2 A:ASP84 3.6 37.0 1.0
CA A:CA404 3.6 55.2 1.0
NZ A:LYS194 3.9 52.6 1.0
O2A A:DMA401 4.0 65.6 1.0
OE1 A:GLN170 4.1 36.6 1.0
O1 A:DMA401 4.1 53.5 1.0
C1 A:DMA401 4.4 47.5 1.0
C2 A:DMA401 4.5 51.6 1.0
CB A:ASP88 4.5 32.0 1.0
NE2 A:GLN170 4.5 30.5 1.0
OD2 A:ASP173 4.7 44.5 1.0
CB A:ASP84 4.7 26.1 1.0
O3A A:DMA401 4.7 61.9 1.0
CD A:GLN170 4.7 35.3 1.0
O A:ASP84 4.8 26.3 1.0
O A:HOH605 5.0 38.9 1.0
O2B A:DMA401 5.0 58.6 1.0

Calcium binding site 2 out of 2 in 8f8l

Go back to Calcium Binding Sites List in 8f8l
Calcium binding site 2 out of 2 in the The Structure of RV2173 From M. Tuberculosis with Dmap Bound


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 2 of The Structure of RV2173 From M. Tuberculosis with Dmap Bound within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca404

b:55.2
occ:1.00
OD2 A:ASP88 2.1 42.3 1.0
O A:HOH506 2.2 32.1 1.0
OD2 A:ASP84 2.2 37.0 1.0
O2B A:DMA401 2.3 58.6 1.0
O A:HOH605 2.4 38.9 1.0
O1A A:DMA401 2.7 53.0 1.0
CG A:ASP88 3.0 30.4 1.0
CG A:ASP84 3.2 31.6 1.0
CB A:ASP88 3.4 32.0 1.0
PB A:DMA401 3.6 66.5 1.0
OD1 A:ASP84 3.6 35.6 1.0
CA A:CA403 3.6 45.7 1.0
O3A A:DMA401 3.8 61.9 1.0
PA A:DMA401 3.8 48.6 1.0
O A:ASP84 4.0 26.3 1.0
OG A:SER90 4.0 34.3 1.0
OD1 A:ASP88 4.1 40.5 1.0
NH2 A:ARG93 4.1 28.2 1.0
OD1 A:ASP85 4.3 31.1 1.0
O1B A:DMA401 4.4 72.3 1.0
C A:ASP84 4.4 29.1 1.0
CB A:ASP84 4.5 26.1 1.0
O3B A:DMA401 4.6 49.8 1.0
C1 A:DMA401 4.7 47.5 1.0
O A:HOH558 4.7 36.8 1.0
O1 A:DMA401 4.8 53.5 1.0
CA A:ASP88 4.9 30.3 1.0
N A:ASP85 4.9 29.5 1.0
O2A A:DMA401 4.9 65.6 1.0
CA A:ASP85 5.0 24.1 1.0

Reference:

J.M.Johnston, T.M.Allison, J.Titterington, C.P.H.Beasley. The Structure of RV2173 From M. Tuberculosis in Apo-, Ipp-, and Dmap-Bound Forms. To Be Published.
Page generated: Fri Jul 19 08:50:40 2024

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