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Magnesium in PDB 9r2e: Structure of Argx-121 Fab Fragment in Complex with the Fc Fragment of IGA1

Protein crystallography data

The structure of Structure of Argx-121 Fab Fragment in Complex with the Fc Fragment of IGA1, PDB code: 9r2e was solved by E.Pannecoucke, S.Voet, L.Deweirdt, J.Verbeiren, S.Gabriels, M.Provost, R.Freier, J.Koenig, A.Lammens, K.Silence, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 116.16 / 2.54
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 77.291, 232.312, 105.519, 90, 90.35, 90
R / Rfree (%) 21.1 / 25.2

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Structure of Argx-121 Fab Fragment in Complex with the Fc Fragment of IGA1 (pdb code 9r2e). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 3 binding sites of Magnesium where determined in the Structure of Argx-121 Fab Fragment in Complex with the Fc Fragment of IGA1, PDB code: 9r2e:
Jump to Magnesium binding site number: 1; 2; 3;

Magnesium binding site 1 out of 3 in 9r2e

Go back to Magnesium Binding Sites List in 9r2e
Magnesium binding site 1 out of 3 in the Structure of Argx-121 Fab Fragment in Complex with the Fc Fragment of IGA1


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Structure of Argx-121 Fab Fragment in Complex with the Fc Fragment of IGA1 within 5.0Å range:
probe atom residue distance (Å) B Occ
L:Mg302

b:35.4
occ:1.00
NE2 L:HIS192 2.2 47.1 1.0
O L:HOH470 2.8 77.6 1.0
CD2 L:HIS192 3.1 48.4 1.0
CE1 L:HIS192 3.2 51.1 1.0
CG L:HIS192 4.2 50.4 1.0
ND1 L:HIS192 4.3 51.6 1.0
CB L:ALA154 4.7 45.2 1.0
O L:HOH463 4.7 43.4 1.0

Magnesium binding site 2 out of 3 in 9r2e

Go back to Magnesium Binding Sites List in 9r2e
Magnesium binding site 2 out of 3 in the Structure of Argx-121 Fab Fragment in Complex with the Fc Fragment of IGA1


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Structure of Argx-121 Fab Fragment in Complex with the Fc Fragment of IGA1 within 5.0Å range:
probe atom residue distance (Å) B Occ
P:Mg501

b:71.5
occ:0.50
OE2 P:GLU313 2.0 91.7 1.0
NE2 P:HIS317 2.5 86.9 1.0
CD2 P:HIS317 3.0 88.4 1.0
CD P:GLU313 3.0 93.7 1.0
OE1 P:GLU313 3.4 97.3 1.0
CE1 P:HIS317 3.6 85.4 1.0
CG P:HIS317 4.1 87.4 1.0
CG P:GLU313 4.2 94.2 1.0
ND1 P:HIS317 4.4 85.6 1.0
O P:GLU313 4.5 89.7 1.0

Magnesium binding site 3 out of 3 in 9r2e

Go back to Magnesium Binding Sites List in 9r2e
Magnesium binding site 3 out of 3 in the Structure of Argx-121 Fab Fragment in Complex with the Fc Fragment of IGA1


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 3 of Structure of Argx-121 Fab Fragment in Complex with the Fc Fragment of IGA1 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg301

b:33.8
occ:0.50
NE2 B:HIS192 2.2 53.0 1.0
CE1 B:HIS192 2.9 55.9 1.0
O B:HOH468 3.2 55.3 1.0
O B:HOH461 3.2 46.1 1.0
CD2 B:HIS192 3.4 51.5 1.0
ND1 B:HIS192 4.1 55.2 1.0
CG B:HIS192 4.4 52.1 1.0

Reference:

S.Voet, M.Provost, L.Deweirdt, J.Verbeiren, S.Gabriels, K.Silence, E.Pannecoucke. Structure of Argx-121 Fab Fragment in Complex with the Fc Fragment of IGA1 To Be Published.
Page generated: Sat Aug 16 07:12:24 2025

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