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Chlorine in PDB 4oc5: X-Ray Structure of of Human Glutamate Carboxypeptidase II (Gcpii) in A Complex with Chibzl, A Urea-Based Inhibitor N~2~-{[(S)-Carboxy(4- Hydroxyphenyl)Methyl]Carbamoyl}-N~6~-(4-Iodobenzoyl)-L-Lysine
Enzymatic activity of X-Ray Structure of of Human Glutamate Carboxypeptidase II (Gcpii) in A Complex with Chibzl, A Urea-Based Inhibitor N~2~-{[(S)-Carboxy(4- Hydroxyphenyl)Methyl]Carbamoyl}-N~6~-(4-Iodobenzoyl)-L-Lysine
All present enzymatic activity of X-Ray Structure of of Human Glutamate Carboxypeptidase II (Gcpii) in A Complex with Chibzl, A Urea-Based Inhibitor N~2~-{[(S)-Carboxy(4- Hydroxyphenyl)Methyl]Carbamoyl}-N~6~-(4-Iodobenzoyl)-L-Lysine:
3.4.17.21;
3.4.17.21;
Protein crystallography data
The structure of X-Ray Structure of of Human Glutamate Carboxypeptidase II (Gcpii) in A Complex with Chibzl, A Urea-Based Inhibitor N~2~-{[(S)-Carboxy(4- Hydroxyphenyl)Methyl]Carbamoyl}-N~6~-(4-Iodobenzoyl)-L-Lysine, PDB code: 4oc5
was solved by
J.Pavlicek,
J.Ptacek,
J.Cerny,
Y.Byun,
L.Skultetyova,
M.Pomper,
J.Lubkowski,
C.Barinka,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 20.00 / 1.70 |
| Space group | I 2 2 2 |
| Cell size a, b, c (Å), α, β, γ (°) | 101.578, 130.446, 159.066, 90.00, 90.00, 90.00 |
| R / Rfree (%) | 16.9 / 20.4 |
Other elements in 4oc5:
The structure of X-Ray Structure of of Human Glutamate Carboxypeptidase II (Gcpii) in A Complex with Chibzl, A Urea-Based Inhibitor N~2~-{[(S)-Carboxy(4- Hydroxyphenyl)Methyl]Carbamoyl}-N~6~-(4-Iodobenzoyl)-L-Lysine also contains other interesting chemical elements:
| Iodine | (I) | 1 atom |
| Calcium | (Ca) | 1 atom |
| Zinc | (Zn) | 2 atoms |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the X-Ray Structure of of Human Glutamate Carboxypeptidase II (Gcpii) in A Complex with Chibzl, A Urea-Based Inhibitor N~2~-{[(S)-Carboxy(4- Hydroxyphenyl)Methyl]Carbamoyl}-N~6~-(4-Iodobenzoyl)-L-Lysine
(pdb code 4oc5). 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 X-Ray Structure of of Human Glutamate Carboxypeptidase II (Gcpii) in A Complex with Chibzl, A Urea-Based Inhibitor N~2~-{[(S)-Carboxy(4- Hydroxyphenyl)Methyl]Carbamoyl}-N~6~-(4-Iodobenzoyl)-L-Lysine, PDB code: 4oc5:
In total only one binding site of Chlorine was determined in the X-Ray Structure of of Human Glutamate Carboxypeptidase II (Gcpii) in A Complex with Chibzl, A Urea-Based Inhibitor N~2~-{[(S)-Carboxy(4- Hydroxyphenyl)Methyl]Carbamoyl}-N~6~-(4-Iodobenzoyl)-L-Lysine, PDB code: 4oc5:
Chlorine binding site 1 out of 1 in 4oc5
Go back to
Chlorine Binding Sites List in 4oc5
Chlorine binding site 1 out
of 1 in the X-Ray Structure of of Human Glutamate Carboxypeptidase II (Gcpii) in A Complex with Chibzl, A Urea-Based Inhibitor N~2~-{[(S)-Carboxy(4- Hydroxyphenyl)Methyl]Carbamoyl}-N~6~-(4-Iodobenzoyl)-L-Lysine
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 X-Ray Structure of of Human Glutamate Carboxypeptidase II (Gcpii) in A Complex with Chibzl, A Urea-Based Inhibitor N~2~-{[(S)-Carboxy(4- Hydroxyphenyl)Methyl]Carbamoyl}-N~6~-(4-Iodobenzoyl)-L-Lysine within 5.0Å range:
|
Reference:
J.Pavlicek,
J.Ptacek,
J.Cerny,
Y.Byun,
L.Skultetyova,
M.G.Pomper,
J.Lubkowski,
C.Barinka.
Structural Characterization of P1'-Diversified Urea-Based Inhibitors of Glutamate Carboxypeptidase II. Bioorg.Med.Chem.Lett. V. 24 2340 2014.
ISSN: ISSN 0960-894X
PubMed: 24731280
DOI: 10.1016/J.BMCL.2014.03.066
Page generated: Sat Dec 12 11:00:46 2020
ISSN: ISSN 0960-894X
PubMed: 24731280
DOI: 10.1016/J.BMCL.2014.03.066
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