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Chlorine in PDB 7jr8: H-Pdgs Complexed with A 2-Phenylimidazo[1,2-A]Pyridine-6-Carboxamide Inhibitors
Enzymatic activity of H-Pdgs Complexed with A 2-Phenylimidazo[1,2-A]Pyridine-6-Carboxamide Inhibitors
All present enzymatic activity of H-Pdgs Complexed with A 2-Phenylimidazo[1,2-A]Pyridine-6-Carboxamide Inhibitors:
2.5.1.18; 5.3.99.2;
2.5.1.18; 5.3.99.2;
Protein crystallography data
The structure of H-Pdgs Complexed with A 2-Phenylimidazo[1,2-A]Pyridine-6-Carboxamide Inhibitors, PDB code: 7jr8
was solved by
R.T.Nolte,
D.O.Somers,
R.T.Gampe,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 32.55 / 1.13 |
| Space group | P 1 21 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 47.082, 93.489, 47.913, 90, 105.52, 90 |
| R / Rfree (%) | 11.5 / 14.3 |
Other elements in 7jr8:
The structure of H-Pdgs Complexed with A 2-Phenylimidazo[1,2-A]Pyridine-6-Carboxamide Inhibitors also contains other interesting chemical elements:
| Magnesium | (Mg) | 2 atoms |
| Sodium | (Na) | 3 atoms |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the H-Pdgs Complexed with A 2-Phenylimidazo[1,2-A]Pyridine-6-Carboxamide Inhibitors
(pdb code 7jr8). 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 H-Pdgs Complexed with A 2-Phenylimidazo[1,2-A]Pyridine-6-Carboxamide Inhibitors, PDB code: 7jr8:
In total only one binding site of Chlorine was determined in the H-Pdgs Complexed with A 2-Phenylimidazo[1,2-A]Pyridine-6-Carboxamide Inhibitors, PDB code: 7jr8:
Chlorine binding site 1 out of 1 in 7jr8
Go back to
Chlorine Binding Sites List in 7jr8
Chlorine binding site 1 out
of 1 in the H-Pdgs Complexed with A 2-Phenylimidazo[1,2-A]Pyridine-6-Carboxamide Inhibitors
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 H-Pdgs Complexed with A 2-Phenylimidazo[1,2-A]Pyridine-6-Carboxamide Inhibitors within 5.0Å range:
|
Reference:
D.N.Deaton,
E.Diaz,
Y.Do,
R.T.Gampe,
J.H.Guss,
A.P.Hancock,
H.Hobbs,
S.T.Hodgson,
J.Holt,
M.R.Jeune,
K.M.Kahler,
H.F.Kramer,
J.Le,
P.N.Mortenson,
C.Musetti,
R.T.Nolte,
L.A.Orband-Miller,
G.E.Peckham,
K.G.Petrov,
B.L.Pietrak,
C.Poole,
D.J.Price,
G.Saxty,
C.A.Schulte,
A.Shillings,
T.L.Smalley Jr.,
D.O.Somers,
E.L.Stewart,
J.D.Stuart,
S.A.Thomson.
A Knowledge-Based, Structural-Aided Discovery of A Novel Class of 2-Phenylimidazo[1,2-A]Pyridine-6-Carboxamide H-Pgds Inhibitors. Bioorg.Med.Chem.Lett. 28113 2021.
ISSN: ESSN 1464-3405
PubMed: 33991628
DOI: 10.1016/J.BMCL.2021.128113
Page generated: Sun Jul 13 03:03:59 2025
ISSN: ESSN 1464-3405
PubMed: 33991628
DOI: 10.1016/J.BMCL.2021.128113
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