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Chlorine in PDB 4i9u: Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256
Enzymatic activity of Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256
All present enzymatic activity of Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256:
1.1.1.27;
1.1.1.27;
Protein crystallography data
The structure of Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256, PDB code: 4i9u
was solved by
T.Zhou,
A.Kohlmann,
Z.G.Stephan,
L.Commodore,
M.T.Greenfield,
X.Zhu,
D.C.Dalgarno,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 50.00 / 2.50 |
| Space group | P 1 21 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 83.690, 138.740, 138.170, 90.00, 94.82, 90.00 |
| R / Rfree (%) | 22.2 / 27.3 |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256
(pdb code 4i9u). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 8 binding sites of Chlorine where determined in the Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256, PDB code: 4i9u:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;
In total 8 binding sites of Chlorine where determined in the Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256, PDB code: 4i9u:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;
Chlorine binding site 1 out of 8 in 4i9u
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Chlorine Binding Sites List in 4i9u
Chlorine binding site 1 out
of 8 in the Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256
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 Rabbit Ldha in Complex with A Fragment Inhibitor AP26256 within 5.0Å range:
|
Chlorine binding site 2 out of 8 in 4i9u
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Chlorine Binding Sites List in 4i9u
Chlorine binding site 2 out
of 8 in the Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256
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 2 of Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256 within 5.0Å range:
|
Chlorine binding site 3 out of 8 in 4i9u
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Chlorine Binding Sites List in 4i9u
Chlorine binding site 3 out
of 8 in the Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256
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 3 of Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256 within 5.0Å range:
|
Chlorine binding site 4 out of 8 in 4i9u
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Chlorine Binding Sites List in 4i9u
Chlorine binding site 4 out
of 8 in the Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256
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 4 of Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256 within 5.0Å range:
|
Chlorine binding site 5 out of 8 in 4i9u
Go back to
Chlorine Binding Sites List in 4i9u
Chlorine binding site 5 out
of 8 in the Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256
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 5 of Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256 within 5.0Å range:
|
Chlorine binding site 6 out of 8 in 4i9u
Go back to
Chlorine Binding Sites List in 4i9u
Chlorine binding site 6 out
of 8 in the Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256
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 6 of Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256 within 5.0Å range:
|
Chlorine binding site 7 out of 8 in 4i9u
Go back to
Chlorine Binding Sites List in 4i9u
Chlorine binding site 7 out
of 8 in the Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256
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 7 of Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256 within 5.0Å range:
|
Chlorine binding site 8 out of 8 in 4i9u
Go back to
Chlorine Binding Sites List in 4i9u
Chlorine binding site 8 out
of 8 in the Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256
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 8 of Crystal Structure of Rabbit Ldha in Complex with A Fragment Inhibitor AP26256 within 5.0Å range:
|
Reference:
A.Kohlmann,
S.G.Zech,
F.Li,
T.Zhou,
R.M.Squillace,
L.Commodore,
M.T.Greenfield,
X.Lu,
D.P.Miller,
W.S.Huang,
J.Qi,
R.M.Thomas,
Y.Wang,
S.Zhang,
R.Dodd,
S.Liu,
R.Xu,
Y.Xu,
J.J.Miret,
V.Rivera,
T.Clackson,
W.C.Shakespeare,
X.Zhu,
D.C.Dalgarno.
Fragment Growing and Linking Lead to Novel Nanomolar Lactate Dehydrogenase Inhibitors. J.Med.Chem. V. 56 1023 2013.
ISSN: ISSN 0022-2623
PubMed: 23302067
DOI: 10.1021/JM3014844
Page generated: Sun Jul 21 16:29:16 2024
ISSN: ISSN 0022-2623
PubMed: 23302067
DOI: 10.1021/JM3014844
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