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Magnesium in PDB 3f1t: Crystal Structure of the Q9I3C8_PSEAE Protein From Pseudomonas Aeruginosa. Northeast Structural Genomics Consortium Target PAR319A.

Protein crystallography data

The structure of Crystal Structure of the Q9I3C8_PSEAE Protein From Pseudomonas Aeruginosa. Northeast Structural Genomics Consortium Target PAR319A., PDB code: 3f1t was solved by S.M.Vorobiev, Y.Chen, M.Abashidze, J.Seetharaman, D.Wang, E.L.Foote, C.Ciccosanti, L.Mao, R.Xiao, T.B.Acton, G.T.Montelione, L.Tong, J.F.Hunt, Northeast Structural Genomics Consortium (Nesg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 50.00 / 2.20
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 65.626, 72.988, 120.741, 90.00, 90.00, 90.00
R / Rfree (%) 21.7 / 24.9

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Crystal Structure of the Q9I3C8_PSEAE Protein From Pseudomonas Aeruginosa. Northeast Structural Genomics Consortium Target PAR319A. (pdb code 3f1t). 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 Q9I3C8_PSEAE Protein From Pseudomonas Aeruginosa. Northeast Structural Genomics Consortium Target PAR319A., PDB code: 3f1t:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in 3f1t

Go back to Magnesium Binding Sites List in 3f1t
Magnesium binding site 1 out of 2 in the Crystal Structure of the Q9I3C8_PSEAE Protein From Pseudomonas Aeruginosa. Northeast Structural Genomics Consortium Target PAR319A.


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 Q9I3C8_PSEAE Protein From Pseudomonas Aeruginosa. Northeast Structural Genomics Consortium Target PAR319A. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg201

b:22.9
occ:1.00
CG2 D:THR110 2.8 24.4 1.0
OG1 A:THR110 3.0 30.5 1.0
N D:ASN112 3.2 25.4 1.0
N A:ASN112 3.2 32.8 1.0
CB A:ASN112 3.5 31.4 1.0
CB A:THR110 3.6 29.8 1.0
N D:PRO111 3.7 29.5 1.0
CD D:PRO111 3.8 26.3 1.0
CB D:ASN112 3.8 22.2 1.0
CA A:ASN112 3.8 30.3 1.0
N A:PRO111 3.9 34.0 1.0
CB D:THR110 3.9 27.5 1.0
CA D:ASN112 3.9 23.6 1.0
OG1 D:THR110 3.9 36.6 1.0
CD A:PRO111 3.9 35.1 1.0
CB A:PRO111 4.0 34.7 1.0
CB D:PRO111 4.0 28.2 1.0
ND2 D:ASN112 4.0 30.1 1.0
ND2 A:ASN112 4.0 38.9 1.0
C D:PRO111 4.1 26.5 1.0
C A:PRO111 4.2 34.1 1.0
CA D:PRO111 4.2 27.1 1.0
N A:VAL113 4.2 24.0 1.0
CG D:PRO111 4.2 28.4 1.0
N D:VAL113 4.2 22.6 1.0
CG A:ASN112 4.2 35.8 1.0
CA A:PRO111 4.3 34.8 1.0
C D:THR110 4.3 27.6 1.0
CG2 D:VAL113 4.3 17.7 1.0
CG A:PRO111 4.3 35.8 1.0
CG2 A:VAL113 4.3 20.4 1.0
C A:THR110 4.3 32.2 1.0
C A:ASN112 4.4 27.3 1.0
C D:ASN112 4.4 22.0 1.0
CG D:ASN112 4.5 34.0 1.0
CA A:THR110 4.6 29.9 1.0
CG2 A:THR110 4.7 24.2 1.0
CA D:THR110 4.7 28.2 1.0
CB A:VAL113 4.9 20.5 1.0
CB D:VAL113 5.0 20.8 1.0

Magnesium binding site 2 out of 2 in 3f1t

Go back to Magnesium Binding Sites List in 3f1t
Magnesium binding site 2 out of 2 in the Crystal Structure of the Q9I3C8_PSEAE Protein From Pseudomonas Aeruginosa. Northeast Structural Genomics Consortium Target PAR319A.


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 Q9I3C8_PSEAE Protein From Pseudomonas Aeruginosa. Northeast Structural Genomics Consortium Target PAR319A. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg202

b:18.1
occ:1.00
OG1 B:THR110 2.8 28.2 1.0
N B:ASN112 3.2 24.8 1.0
OG1 C:THR110 3.2 21.0 1.0
N C:ASN112 3.2 28.6 1.0
CB B:THR110 3.5 21.9 1.0
N B:PRO111 3.7 23.0 1.0
CD B:PRO111 3.8 20.5 1.0
CB C:THR110 3.8 23.8 1.0
CD C:PRO111 3.8 23.1 1.0
CB C:ASN112 3.9 24.6 1.0
CA C:ASN112 3.9 26.2 1.0
N C:PRO111 3.9 26.7 1.0
CB B:ASN112 3.9 24.4 1.0
CA B:ASN112 3.9 24.8 1.0
CB B:PRO111 4.1 25.0 1.0
C B:PRO111 4.1 24.6 1.0
CB C:PRO111 4.1 26.6 1.0
N C:VAL113 4.1 25.6 1.0
N B:VAL113 4.2 23.2 1.0
C B:THR110 4.2 23.1 1.0
C C:PRO111 4.2 29.5 1.0
CA B:PRO111 4.2 24.0 1.0
CG2 B:VAL113 4.2 14.7 1.0
C C:ASN112 4.3 25.2 1.0
ND2 C:ASN112 4.3 28.7 1.0
ND2 B:ASN112 4.3 35.4 1.0
CG C:PRO111 4.3 27.5 1.0
CA C:PRO111 4.3 27.3 1.0
CG B:PRO111 4.4 24.8 1.0
C B:ASN112 4.4 24.0 1.0
C C:THR110 4.4 23.9 1.0
CG2 C:VAL113 4.4 20.2 1.0
CA B:THR110 4.5 22.4 1.0
CG2 B:THR110 4.6 21.1 1.0
CG C:ASN112 4.6 28.6 1.0
CG B:ASN112 4.7 33.0 1.0
CA C:THR110 4.7 22.7 1.0
CG2 C:THR110 4.8 20.4 1.0
CB B:VAL113 4.8 17.5 1.0
CB C:VAL113 4.9 24.1 1.0
O B:THR110 5.0 23.4 1.0

Reference:

S.M.Vorobiev, Y.Chen, M.Abashidze, J.Seetharaman, D.Wang, E.L.Foote, C.Ciccosanti, L.Mao, R.Xiao, T.B.Acton, G.T.Montelione, L.Tong, J.F.Hunt. Crystal Structure of the Q9I3C8_PSEAE Protein From Pseudomonas Aeruginosa. To Be Published.
Page generated: Sun Aug 10 20:44:21 2025

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