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Praseodymium in PDB 2vxc: Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide.

Protein crystallography data

The structure of Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide., PDB code: 2vxc was solved by M.L.Kilkenny, S.M.Roe, L.H.Pearl, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 65.00 / 3.10
Space group P 21 21 2
Cell size a, b, c (Å), α, β, γ (°) 73.358, 140.415, 56.875, 90.00, 90.00, 90.00
R / Rfree (%) 19.5 / 24.4

Praseodymium Binding Sites:

The binding sites of Praseodymium atom in the Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide. (pdb code 2vxc). This binding sites where shown within 5.0 Angstroms radius around Praseodymium atom.
In total 4 binding sites of Praseodymium where determined in the Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide., PDB code: 2vxc:
Jump to Praseodymium binding site number: 1; 2; 3; 4;

Praseodymium binding site 1 out of 4 in 2vxc

Go back to Praseodymium Binding Sites List in 2vxc
Praseodymium binding site 1 out of 4 in the Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide.


Mono view


Stereo pair view

A full contact list of Praseodymium with other atoms in the Pr binding site number 1 of Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Pr1779

b:36.8
occ:1.00
OD2 A:ASP541 2.3 89.8 1.0
O A:HOH2001 2.3 19.3 1.0
OD1 A:ASP542 2.4 64.9 1.0
CG A:ASP541 3.0 87.3 1.0
OD2 A:ASP542 3.0 69.0 1.0
CG A:ASP542 3.1 57.5 1.0
OD1 A:ASP541 3.4 65.1 1.0
NE2 A:GLN537 4.0 0.0 1.0
CB A:ASP541 4.1 93.1 1.0
OE1 A:GLN537 4.3 87.9 1.0
CB A:ASP542 4.5 45.8 1.0
CD A:GLN537 4.6 95.3 1.0
C A:ASP541 4.8 86.7 1.0
N A:ASP542 5.0 53.8 1.0
O A:ASP541 5.0 98.2 1.0

Praseodymium binding site 2 out of 4 in 2vxc

Go back to Praseodymium Binding Sites List in 2vxc
Praseodymium binding site 2 out of 4 in the Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide.


Mono view


Stereo pair view

A full contact list of Praseodymium with other atoms in the Pr binding site number 2 of Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Pr1780

b:0.8
occ:1.00
OD2 A:ASP662 2.8 68.6 1.0
O A:HIS659 2.9 52.1 1.0
CG A:ASP662 3.5 61.8 1.0
OD1 A:ASP662 3.9 62.5 1.0
C A:HIS659 3.9 32.6 1.0
CA A:HIS659 4.4 28.0 1.0
CB A:ASP662 4.6 28.4 1.0
CB A:HIS659 4.6 29.2 1.0
N A:ASP662 4.9 26.3 1.0

Praseodymium binding site 3 out of 4 in 2vxc

Go back to Praseodymium Binding Sites List in 2vxc
Praseodymium binding site 3 out of 4 in the Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide.


Mono view


Stereo pair view

A full contact list of Praseodymium with other atoms in the Pr binding site number 3 of Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Pr1779

b:64.3
occ:1.00
OD1 B:ASP542 2.7 68.9 1.0
OD2 B:ASP541 2.7 88.8 1.0
OD2 B:ASP542 3.4 73.8 1.0
CG B:ASP542 3.4 62.7 1.0
CG B:ASP541 3.5 88.4 1.0
O B:HOH2002 3.5 13.5 1.0
PR B:PR1780 3.7 0.2 1.0
OD1 B:ASP541 3.8 73.8 1.0
CB B:ASP541 4.6 92.3 1.0
CB B:ASP542 4.9 45.9 1.0

Praseodymium binding site 4 out of 4 in 2vxc

Go back to Praseodymium Binding Sites List in 2vxc
Praseodymium binding site 4 out of 4 in the Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide.


Mono view


Stereo pair view

A full contact list of Praseodymium with other atoms in the Pr binding site number 4 of Structure of the CRB2-BRCT2 Domain Complex with Phosphopeptide. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Pr1780

b:0.2
occ:1.00
O B:SER603 2.6 54.1 1.0
OD1 B:ASP542 2.9 68.9 1.0
O B:HOH2002 3.3 13.5 1.0
O B:HOH2008 3.3 24.4 1.0
C B:SER603 3.6 52.1 1.0
PR B:PR1779 3.7 64.3 1.0
CG B:ASP542 3.8 62.7 1.0
CA B:SER603 4.2 59.8 1.0
CB B:ASP542 4.3 45.9 1.0
N B:TRP604 4.6 41.4 1.0
OD2 B:ASP542 4.6 73.8 1.0
CB B:SER603 4.8 68.5 1.0
CA B:TRP604 4.8 44.6 1.0
CA B:ASP542 5.0 42.3 1.0

Reference:

M.L.Kilkenny, A.Dore, S.M.Roe, K.Nestoras, J.C.Y.Ho, F.Z.Watts, L.H.Pearl. Structural and Functional Analysis of the CRB2-BRCT2 Domain Reveals Distinct Roles in Checkpoint Signaling and Dna Damage Repair. Genes Dev. V. 22 2034 2008.
ISSN: ISSN 0890-9369
PubMed: 18676809
DOI: 10.1101/GAD.472808
Page generated: Thu Oct 10 10:24:38 2024

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