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Chlorine in PDB 8txg: Crystal Structure of Kras G12D in Complex with Gdp and Compound 8
Enzymatic activity of Crystal Structure of Kras G12D in Complex with Gdp and Compound 8
All present enzymatic activity of Crystal Structure of Kras G12D in Complex with Gdp and Compound 8:
3.6.5.2;
3.6.5.2;
Protein crystallography data
The structure of Crystal Structure of Kras G12D in Complex with Gdp and Compound 8, PDB code: 8txg
was solved by
P.Chen,
A.Irimia,
Z.Yang,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 19.28 / 1.50 |
| Space group | H 3 2 |
| Cell size a, b, c (Å), α, β, γ (°) | 74.327, 74.327, 202.985, 90, 90, 120 |
| R / Rfree (%) | 19.8 / 22.3 |
Other elements in 8txg:
The structure of Crystal Structure of Kras G12D in Complex with Gdp and Compound 8 also contains other interesting chemical elements:
| Fluorine | (F) | 3 atoms |
| Magnesium | (Mg) | 1 atom |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Crystal Structure of Kras G12D in Complex with Gdp and Compound 8
(pdb code 8txg). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Crystal Structure of Kras G12D in Complex with Gdp and Compound 8, PDB code: 8txg:
In total only one binding site of Chlorine was determined in the Crystal Structure of Kras G12D in Complex with Gdp and Compound 8, PDB code: 8txg:
Chlorine binding site 1 out of 1 in 8txg
Go back to
Chlorine Binding Sites List in 8txg
Chlorine binding site 1 out
of 1 in the Crystal Structure of Kras G12D in Complex with Gdp and Compound 8
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Crystal Structure of Kras G12D in Complex with Gdp and Compound 8 within 5.0Å range:
|
Reference:
H.Cheng,
P.Li,
P.Chen,
A.Irimia,
J.H.Bae,
A.Brooun,
P.Fagan,
R.Lam,
B.Lin,
J.Zhang,
X.Zhan,
X.Wu,
N.Xie,
G.Chiang,
R.Shoemaker,
J.M.Vernier.
Structure-Based Design and Synthesis of Potent and Selective Kras G12D Inhibitors. Acs Med.Chem.Lett. V. 14 1351 2023.
ISSN: ISSN 1948-5875
PubMed: 37849557
DOI: 10.1021/ACSMEDCHEMLETT.3C00245
Page generated: Thu Dec 28 03:33:15 2023
ISSN: ISSN 1948-5875
PubMed: 37849557
DOI: 10.1021/ACSMEDCHEMLETT.3C00245
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