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Chlorine in PDB 3ej2: Crystal Structure of Inorganic Pyrophosphatase From Burkholderia Pseudomallei with Bound 5-Amino-1-(4-Chlorophenyl)-1H-Pyrazole-4- Carbonitrile, H32 Crystal Form

Enzymatic activity of Crystal Structure of Inorganic Pyrophosphatase From Burkholderia Pseudomallei with Bound 5-Amino-1-(4-Chlorophenyl)-1H-Pyrazole-4- Carbonitrile, H32 Crystal Form

All present enzymatic activity of Crystal Structure of Inorganic Pyrophosphatase From Burkholderia Pseudomallei with Bound 5-Amino-1-(4-Chlorophenyl)-1H-Pyrazole-4- Carbonitrile, H32 Crystal Form:
3.6.1.1;

Protein crystallography data

The structure of Crystal Structure of Inorganic Pyrophosphatase From Burkholderia Pseudomallei with Bound 5-Amino-1-(4-Chlorophenyl)-1H-Pyrazole-4- Carbonitrile, H32 Crystal Form, PDB code: 3ej2 was solved by Seattle Structural Genomics Center For Infectious Disease (Ssgcid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 50.00 / 2.12
Space group H 3 2
Cell size a, b, c (Å), α, β, γ (°) 68.496, 68.496, 193.565, 90.00, 90.00, 120.00
R / Rfree (%) 20.3 / 24.9

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Inorganic Pyrophosphatase From Burkholderia Pseudomallei with Bound 5-Amino-1-(4-Chlorophenyl)-1H-Pyrazole-4- Carbonitrile, H32 Crystal Form (pdb code 3ej2). 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 Inorganic Pyrophosphatase From Burkholderia Pseudomallei with Bound 5-Amino-1-(4-Chlorophenyl)-1H-Pyrazole-4- Carbonitrile, H32 Crystal Form, PDB code: 3ej2:

Chlorine binding site 1 out of 1 in 3ej2

Go back to Chlorine Binding Sites List in 3ej2
Chlorine binding site 1 out of 1 in the Crystal Structure of Inorganic Pyrophosphatase From Burkholderia Pseudomallei with Bound 5-Amino-1-(4-Chlorophenyl)-1H-Pyrazole-4- Carbonitrile, H32 Crystal Form


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 Inorganic Pyrophosphatase From Burkholderia Pseudomallei with Bound 5-Amino-1-(4-Chlorophenyl)-1H-Pyrazole-4- Carbonitrile, H32 Crystal Form within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl176

b:59.2
occ:1.00
 CL12 A:928176 0.0 59.2 1.0
C9 A:928176 1.8 55.5 1.0
C8 A:928176 2.8 54.7 1.0
C10 A:928176 2.8 55.0 1.0
CD1 A:LEU121 3.6 35.5 1.0
CG2 A:ILE75 3.7 26.0 1.0
CD A:PRO128 4.0 30.7 1.0
C7 A:928176 4.1 53.0 1.0
C11 A:928176 4.1 52.5 1.0
CD2 A:LEU131 4.4 27.7 1.0
CG A:PRO128 4.5 30.4 1.0
CG A:LEU121 4.6 36.4 1.0
C6 A:928176 4.6 51.6 1.0
CD2 A:LEU121 4.7 36.7 1.0
O A:HOH221 4.8 44.5 1.0
CD1 A:ILE75 4.8 27.9 1.0
CB A:ILE75 4.8 26.1 1.0

Reference:

L.Baugh, L.A.Gallagher, R.Patrapuvich, M.C.Clifton, A.S.Gardberg, T.E.Edwards, B.Armour, D.W.Begley, S.H.Dieterich, D.M.Dranow, J.Abendroth, J.W.Fairman, D.Fox, B.L.Staker, I.Phan, A.Gillespie, R.Choi, S.Nakazawa-Hewitt, M.T.Nguyen, A.Napuli, L.Barrett, G.W.Buchko, R.Stacy, P.J.Myler, L.J.Stewart, C.Manoil, W.C.Van Voorhis. Combining Functional and Structural Genomics to Sample the Essential Burkholderia Structome. Plos One V. 8 53851 2013.
ISSN: ESSN 1932-6203
PubMed: 23382856
DOI: 10.1371/JOURNAL.PONE.0053851
Page generated: Sat Dec 12 09:40:15 2020

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