Atomistry » Magnesium » PDB 2uxj-2v7y » 2v7a
Atomistry »
  Magnesium »
    PDB 2uxj-2v7y »
      2v7a »

Magnesium in PDB 2v7a: Crystal Structure of the T315I Abl Mutant in Complex with the Inhibitor Pha-739358

Enzymatic activity of Crystal Structure of the T315I Abl Mutant in Complex with the Inhibitor Pha-739358

All present enzymatic activity of Crystal Structure of the T315I Abl Mutant in Complex with the Inhibitor Pha-739358:
2.7.10.2;

Protein crystallography data

The structure of Crystal Structure of the T315I Abl Mutant in Complex with the Inhibitor Pha-739358, PDB code: 2v7a was solved by M.Modugno, E.Casale, C.Soncini, P.Rosettani, R.Colombo, R.Lupi, L.Rusconi, D.Fancelli, P.Carpinelli, A.D.Cameron, A.Isacchi, J.Moll, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 30.00 / 2.50
Space group P 62
Cell size a, b, c (Å), α, β, γ (°) 159.757, 159.757, 56.931, 90.00, 90.00, 120.00
R / Rfree (%) 20.7 / 24.6

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Crystal Structure of the T315I Abl Mutant in Complex with the Inhibitor Pha-739358 (pdb code 2v7a). 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 T315I Abl Mutant in Complex with the Inhibitor Pha-739358, PDB code: 2v7a:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in 2v7a

Go back to Magnesium Binding Sites List in 2v7a
Magnesium binding site 1 out of 2 in the Crystal Structure of the T315I Abl Mutant in Complex with the Inhibitor Pha-739358


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 T315I Abl Mutant in Complex with the Inhibitor Pha-739358 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1505

b:32.9
occ:1.00
OD1 A:ASP381 2.1 20.8 1.0
O A:HOH2054 2.4 20.3 1.0
OD1 A:ASN368 2.4 16.1 1.0
CG A:ASP381 3.3 18.0 1.0
CG A:ASN368 3.5 13.5 1.0
O A:HOH2058 3.6 27.0 1.0
O A:HOH2007 3.8 16.3 1.0
OD2 A:ASP381 4.0 16.7 1.0
ND2 A:ASN368 4.0 7.9 1.0
O A:HOH2047 4.2 23.2 1.0
CB A:ASP381 4.4 15.8 1.0
O A:HOH2049 4.4 23.6 1.0
CB A:ASN368 4.6 12.8 1.0
O A:ARG367 4.7 14.2 1.0
OD2 A:ASP363 4.7 24.1 1.0
C36 A:6271504 4.8 15.5 1.0
CA A:ASN368 5.0 13.3 1.0

Magnesium binding site 2 out of 2 in 2v7a

Go back to Magnesium Binding Sites List in 2v7a
Magnesium binding site 2 out of 2 in the Crystal Structure of the T315I Abl Mutant in Complex with the Inhibitor Pha-739358


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 T315I Abl Mutant in Complex with the Inhibitor Pha-739358 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg1505

b:49.2
occ:1.00
OD1 B:ASP381 2.2 40.0 1.0
CG B:ASP381 2.9 39.7 1.0
OD1 B:ASN368 2.9 35.7 1.0
OD2 B:ASP381 3.3 42.1 1.0
CG B:ASN368 3.7 32.2 1.0
CB B:ASP381 4.0 37.8 1.0
ND2 B:ASN368 4.1 30.9 1.0
O B:HOH2020 4.7 30.3 1.0
CB B:ASN368 4.8 30.3 1.0
OD2 B:ASP363 4.8 37.1 1.0
NE2 B:GLN252 4.8 56.0 1.0
O B:HOH2022 4.8 34.8 1.0

Reference:

M.Modugno, E.Casale, C.Soncini, P.Rosettani, R.Colombo, R.Lupi, L.Rusconi, D.Fancelli, P.Carpinelli, A.D.Cameron, A.Isacchi, J.Moll. Crystal Structure of the T315I Abl Mutant in Complex with the Aurora Kinases Inhibitor Pha-739358. Cancer Res. V. 67 7987 2007.
ISSN: ISSN 0008-5472
PubMed: 17804707
DOI: 10.1158/0008-5472.CAN-07-1825
Page generated: Wed Aug 14 05:00:54 2024

Last articles

Mg in 4Y52
Mg in 4Y30
Mg in 4Y2V
Mg in 4Y2X
Mg in 4Y2Y
Mg in 4Y2U
Mg in 4Y2T
Mg in 4Y2Q
Mg in 4Y2R
Mg in 4Y2S
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy