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Chlorine in PDB 1htb: Crystallization of Human BETA3 Alcohol Dehydrogenase (10 Mg/Ml) in 100 Mm Sodium Phosphate (pH 7.5), 7.5 Mm Nad+ and 1 Mm 4-Iodopyrazole at 25 C

Enzymatic activity of Crystallization of Human BETA3 Alcohol Dehydrogenase (10 Mg/Ml) in 100 Mm Sodium Phosphate (pH 7.5), 7.5 Mm Nad+ and 1 Mm 4-Iodopyrazole at 25 C

All present enzymatic activity of Crystallization of Human BETA3 Alcohol Dehydrogenase (10 Mg/Ml) in 100 Mm Sodium Phosphate (pH 7.5), 7.5 Mm Nad+ and 1 Mm 4-Iodopyrazole at 25 C:
1.1.1.1;

Protein crystallography data

The structure of Crystallization of Human BETA3 Alcohol Dehydrogenase (10 Mg/Ml) in 100 Mm Sodium Phosphate (pH 7.5), 7.5 Mm Nad+ and 1 Mm 4-Iodopyrazole at 25 C, PDB code: 1htb was solved by T.D.Hurley, G.J.Davis, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 8.00 / 2.40
Space group P 1
Cell size a, b, c (Å), α, β, γ (°) 54.030, 44.430, 92.740, 92.71, 103.17, 69.15
R / Rfree (%) 17.5 / 24.3

Other elements in 1htb:

The structure of Crystallization of Human BETA3 Alcohol Dehydrogenase (10 Mg/Ml) in 100 Mm Sodium Phosphate (pH 7.5), 7.5 Mm Nad+ and 1 Mm 4-Iodopyrazole at 25 C also contains other interesting chemical elements:

Iodine (I) 2 atoms
Zinc (Zn) 4 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystallization of Human BETA3 Alcohol Dehydrogenase (10 Mg/Ml) in 100 Mm Sodium Phosphate (pH 7.5), 7.5 Mm Nad+ and 1 Mm 4-Iodopyrazole at 25 C (pdb code 1htb). 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 Crystallization of Human BETA3 Alcohol Dehydrogenase (10 Mg/Ml) in 100 Mm Sodium Phosphate (pH 7.5), 7.5 Mm Nad+ and 1 Mm 4-Iodopyrazole at 25 C, PDB code: 1htb:

Chlorine binding site 1 out of 1 in 1htb

Go back to Chlorine Binding Sites List in 1htb
Chlorine binding site 1 out of 1 in the Crystallization of Human BETA3 Alcohol Dehydrogenase (10 Mg/Ml) in 100 Mm Sodium Phosphate (pH 7.5), 7.5 Mm Nad+ and 1 Mm 4-Iodopyrazole at 25 C


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystallization of Human BETA3 Alcohol Dehydrogenase (10 Mg/Ml) in 100 Mm Sodium Phosphate (pH 7.5), 7.5 Mm Nad+ and 1 Mm 4-Iodopyrazole at 25 C within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl601

b:47.6
occ:1.00
 CD B:ARG128 3.4 26.4 1.0
N B:ARG128 3.6 29.7 1.0
NH1 B:ARG128 3.6 29.2 1.0
CB B:ARG128 4.2 23.1 1.0
O B:HOH610 4.2 23.4 1.0
CB B:THR127 4.3 21.7 1.0
CA B:ARG128 4.3 27.3 1.0
O B:ARG128 4.3 26.9 1.0
CA B:THR127 4.4 26.6 1.0
CG B:ARG128 4.4 24.8 1.0
NE B:ARG128 4.4 28.7 1.0
C B:THR127 4.5 28.5 1.0
CZ B:ARG128 4.5 31.6 1.0
O B:HOH633 4.5 52.2 1.0
CG2 B:THR127 4.7 21.2 1.0
C B:ARG128 4.8 26.7 1.0
CB B:PRO136 5.0 29.9 1.0

Reference:

G.J.Davis, W.F.Bosron, C.L.Stone, K.Owusu-Dekyi, T.D.Hurley. X-Ray Structure of Human BETA3BETA3 Alcohol Dehydrogenase. the Contribution of Ionic Interactions to Coenzyme Binding. J.Biol.Chem. V. 271 17057 1996.
ISSN: ISSN 0021-9258
PubMed: 8663387
DOI: 10.1074/JBC.271.29.17057
Page generated: Fri Jul 19 22:35:18 2024

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