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Sodium in PDB 3gjc: Crystal Structure of the E290S Mutant of Leut with Bound Og

Protein crystallography data

The structure of Crystal Structure of the E290S Mutant of Leut with Bound Og, PDB code: 3gjc was solved by A.M.L.Winther, M.Quick, J.A.Javitch, P.Nissen, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 29.20 / 2.80
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 83.790, 93.510, 87.460, 90.00, 94.22, 90.00
R / Rfree (%) 22.1 / 26.7

Sodium Binding Sites:

The binding sites of Sodium atom in the Crystal Structure of the E290S Mutant of Leut with Bound Og (pdb code 3gjc). This binding sites where shown within 5.0 Angstroms radius around Sodium atom.
In total 2 binding sites of Sodium where determined in the Crystal Structure of the E290S Mutant of Leut with Bound Og, PDB code: 3gjc:
Jump to Sodium binding site number: 1; 2;

Sodium binding site 1 out of 2 in 3gjc

Go back to Sodium Binding Sites List in 3gjc
Sodium binding site 1 out of 2 in the Crystal Structure of the E290S Mutant of Leut with Bound Og


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 1 of Crystal Structure of the E290S Mutant of Leut with Bound Og within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na514

b:59.6
occ:1.00
O A:GLY20 2.4 48.4 1.0
O A:ALA351 2.6 56.2 1.0
O A:VAL23 2.8 67.6 1.0
OG A:SER355 2.8 44.7 1.0
OG1 A:THR354 3.0 36.6 1.0
C A:VAL23 3.1 39.7 1.0
CA A:GLY24 3.3 38.1 1.0
N A:SER355 3.3 57.4 1.0
N A:GLY24 3.4 42.1 1.0
CB A:SER355 3.4 30.9 1.0
C A:GLY20 3.5 46.4 1.0
C A:THR354 3.6 35.4 1.0
C A:ALA351 3.6 57.3 1.0
CA A:SER355 3.7 45.0 1.0
CB A:THR354 3.7 37.0 1.0
N A:VAL23 3.9 33.4 1.0
O A:ASN21 4.0 34.5 1.0
CA A:VAL23 4.0 15.7 1.0
CA A:GLY20 4.1 38.4 1.0
CA A:THR354 4.1 35.6 1.0
CA A:ALA351 4.2 39.1 1.0
O A:THR354 4.2 41.1 1.0
C A:ASN21 4.3 29.4 1.0
C A:ALA22 4.4 39.9 1.0
N A:THR354 4.4 18.7 1.0
N A:ASN21 4.6 44.4 1.0
CB A:VAL23 4.7 43.1 1.0
C A:GLY24 4.7 34.4 1.0
O A:ALA22 4.8 31.2 1.0
CB A:ALA351 4.8 20.5 1.0
N A:GLY352 4.8 45.6 1.0
N A:ALA22 4.8 38.2 1.0
CA A:ASN21 4.8 34.5 1.0
O A:ALA19 4.9 29.9 1.0
O A:GLY352 4.9 35.5 1.0
O A:PHE350 5.0 36.0 1.0

Sodium binding site 2 out of 2 in 3gjc

Go back to Sodium Binding Sites List in 3gjc
Sodium binding site 2 out of 2 in the Crystal Structure of the E290S Mutant of Leut with Bound Og


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 2 of Crystal Structure of the E290S Mutant of Leut with Bound Og within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Na514

b:36.5
occ:1.00
O B:GLY20 2.4 34.9 1.0
O B:ALA351 2.6 43.8 1.0
O B:VAL23 2.8 55.3 1.0
OG1 B:THR354 2.9 37.5 1.0
OG B:SER355 3.1 42.5 1.0
C B:VAL23 3.1 32.8 1.0
N B:SER355 3.4 53.0 1.0
CA B:GLY24 3.4 36.5 1.0
N B:GLY24 3.4 40.5 1.0
C B:GLY20 3.5 38.6 1.0
CB B:SER355 3.5 16.1 1.0
C B:ALA351 3.6 51.8 1.0
CB B:THR354 3.6 17.8 1.0
C B:THR354 3.7 40.0 1.0
CA B:SER355 3.8 32.3 1.0
N B:VAL23 4.0 27.3 1.0
CA B:VAL23 4.0 33.3 1.0
CA B:GLY20 4.0 22.1 1.0
CA B:ALA351 4.0 36.4 1.0
CA B:THR354 4.1 27.2 1.0
O B:ASN21 4.1 32.5 1.0
O B:THR354 4.2 31.6 1.0
N B:THR354 4.4 26.0 1.0
C B:ASN21 4.4 33.7 1.0
C B:ALA22 4.5 34.0 1.0
N B:ASN21 4.6 46.6 1.0
CB B:ALA351 4.6 10.7 1.0
CB B:VAL23 4.6 45.8 1.0
N B:GLY352 4.8 36.7 1.0
O B:PHE350 4.8 27.2 1.0
C B:GLY24 4.8 31.4 1.0
O B:ALA19 4.8 27.8 1.0
O B:ALA22 4.9 24.2 1.0
N B:ALA22 4.9 33.2 1.0
CA B:ASN21 4.9 21.5 1.0
O B:GLY352 5.0 31.2 1.0
CG2 B:THR354 5.0 32.2 1.0

Reference:

M.Quick, A.M.L.Winther, L.Shi, P.Nissen, H.Weinstein, J.A.Javitch. Binding of An Octylglucoside Detergent Molecule in the Second Substrate (S2) Site of Leut Establishes An Inhibitor-Bound Conformation Proc.Natl.Acad.Sci.Usa V. 106 5563 2009.
ISSN: ISSN 0027-8424
PubMed: 19307590
DOI: 10.1073/PNAS.0811322106
Page generated: Tue Dec 15 06:12:33 2020

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