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Zinc in PDB 2f44: Crystal Structure of the Zinc-Bound Shank Sam Domain

Protein crystallography data

The structure of Crystal Structure of the Zinc-Bound Shank Sam Domain, PDB code: 2f44 was solved by M.K.Baron, J.U.Bowie, S.Faham, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 40.00 / 2.40
Space group P 65
Cell size a, b, c (Å), α, β, γ (°) 104.820, 104.820, 40.192, 90.00, 90.00, 120.00
R / Rfree (%) 25.2 / 28.7

Other elements in 2f44:

The structure of Crystal Structure of the Zinc-Bound Shank Sam Domain also contains other interesting chemical elements:

Chlorine (Cl) 3 atoms

Zinc Binding Sites:

The binding sites of Zinc atom in the Crystal Structure of the Zinc-Bound Shank Sam Domain (pdb code 2f44). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 3 binding sites of Zinc where determined in the Crystal Structure of the Zinc-Bound Shank Sam Domain, PDB code: 2f44:
Jump to Zinc binding site number: 1; 2; 3;

Zinc binding site 1 out of 3 in 2f44

Go back to Zinc Binding Sites List in 2f44
Zinc binding site 1 out of 3 in the Crystal Structure of the Zinc-Bound Shank Sam Domain


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Crystal Structure of the Zinc-Bound Shank Sam Domain within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn255

b:50.6
occ:1.00
NE2 A:HIS22 2.1 38.7 1.0
ND1 A:HIS54 2.1 39.4 1.0
OE2 A:GLU21 2.1 50.0 1.0
CL A:CL256 2.5 51.2 1.0
CE1 A:HIS54 2.8 39.0 1.0
CE1 A:HIS22 3.0 38.6 1.0
CD2 A:HIS22 3.1 38.0 1.0
CD A:GLU21 3.2 49.4 1.0
CG A:HIS54 3.3 37.6 1.0
CG A:GLU21 3.8 44.5 1.0
CB A:HIS54 3.9 36.8 1.0
NH1 A:ARG51 4.0 60.8 1.0
NE2 A:HIS54 4.0 38.5 1.0
ND1 A:HIS22 4.0 37.6 1.0
CG A:HIS22 4.1 38.6 1.0
CD2 A:HIS54 4.2 37.5 1.0
OE1 A:GLU21 4.3 51.5 1.0
CD A:ARG51 4.4 50.4 1.0
CD2 A:LEU19 4.5 44.1 1.0

Zinc binding site 2 out of 3 in 2f44

Go back to Zinc Binding Sites List in 2f44
Zinc binding site 2 out of 3 in the Crystal Structure of the Zinc-Bound Shank Sam Domain


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Crystal Structure of the Zinc-Bound Shank Sam Domain within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Zn256

b:55.2
occ:1.00
ND1 B:HIS54 2.1 44.8 1.0
NE2 B:HIS22 2.1 45.6 1.0
OE2 B:GLU21 2.1 59.9 1.0
CL B:CL257 2.4 53.5 1.0
CE1 B:HIS54 2.9 46.5 1.0
CE1 B:HIS22 2.9 46.9 1.0
CD2 B:HIS22 3.1 45.0 1.0
CG B:HIS54 3.1 45.1 1.0
CD B:GLU21 3.2 60.3 1.0
CB B:HIS54 3.6 43.0 1.0
CG B:GLU21 3.9 57.0 1.0
ND1 B:HIS22 4.0 44.9 1.0
NE2 B:HIS54 4.0 47.4 1.0
CG B:HIS22 4.1 44.8 1.0
CD2 B:HIS54 4.2 46.1 1.0
OE1 B:GLU21 4.2 63.5 1.0
CD2 B:LEU19 4.3 42.5 1.0
CD B:ARG51 4.5 57.3 1.0
CB B:ARG51 4.8 47.6 1.0
CG B:ARG51 4.9 51.1 1.0
NH2 B:ARG51 5.0 69.8 1.0

Zinc binding site 3 out of 3 in 2f44

Go back to Zinc Binding Sites List in 2f44
Zinc binding site 3 out of 3 in the Crystal Structure of the Zinc-Bound Shank Sam Domain


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 3 of Crystal Structure of the Zinc-Bound Shank Sam Domain within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Zn257

b:54.7
occ:1.00
ND1 C:HIS54 2.1 47.2 1.0
NE2 C:HIS22 2.1 43.6 1.0
OE2 C:GLU21 2.1 59.1 1.0
CL C:CL258 2.5 52.6 1.0
CE1 C:HIS54 2.7 48.7 1.0
CE1 C:HIS22 2.9 44.0 1.0
CD2 C:HIS22 3.1 42.7 1.0
CG C:HIS54 3.3 46.0 1.0
CD C:GLU21 3.3 58.7 1.0
NE2 C:HIS54 3.9 47.1 1.0
CB C:HIS54 3.9 43.6 1.0
ND1 C:HIS22 4.1 43.5 1.0
CG C:GLU21 4.1 54.9 1.0
CD2 C:HIS54 4.2 46.3 1.0
CG C:HIS22 4.2 44.5 1.0
OE1 C:GLU21 4.3 60.6 1.0
CD2 C:LEU19 4.6 48.8 1.0
CD C:ARG51 4.6 61.8 1.0
CG C:ARG51 4.8 56.5 1.0
NE C:ARG51 4.9 67.5 1.0
CB C:ARG51 5.0 51.6 1.0

Reference:

M.K.Baron, T.M.Boeckers, B.Vaida, S.Faham, M.Gingery, M.R.Sawaya, D.Salyer, E.D.Gundelfinger, J.U.Bowie. An Architectural Framework That May Lie at the Core of the Postsynaptic Density. Science V. 311 531 2006.
ISSN: ISSN 0036-8075
PubMed: 16439662
DOI: 10.1126/SCIENCE.1118995
Page generated: Wed Oct 16 23:37:08 2024

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