Chlorine in PDB 2wue: Crystal Structure of S114A Mutant of Hsad From Mycobacterium Tuberculosis in Complex with Hopoda

Enzymatic activity of Crystal Structure of S114A Mutant of Hsad From Mycobacterium Tuberculosis in Complex with Hopoda

All present enzymatic activity of Crystal Structure of S114A Mutant of Hsad From Mycobacterium Tuberculosis in Complex with Hopoda:
3.7.1.8;

Protein crystallography data

The structure of Crystal Structure of S114A Mutant of Hsad From Mycobacterium Tuberculosis in Complex with Hopoda, PDB code: 2wue was solved by N.A.Lack, K.C.Yam, E.D.Lowe, G.P.Horsman, R.Owen, E.Sim, L.D.Eltis, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

*Resolution Low / High (Å)*	36.34 / 1.80
*Space group*	F 2 2 2
*Cell size a, b, c (Å), α, β, γ (°)*	111.883, 117.971, 180.893, 90.00, 90.00, 90.00
*R / R_free (%)*	19.4 / 21

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of S114A Mutant of Hsad From Mycobacterium Tuberculosis in Complex with Hopoda (pdb code 2wue). 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 S114A Mutant of Hsad From Mycobacterium Tuberculosis in Complex with Hopoda, PDB code: 2wue:

Chlorine binding site 1 out of 1 in 2wue

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Chlorine Binding Sites List in 2wue

Chlorine binding site 1 out of 1 in the Crystal Structure of S114A Mutant of Hsad From Mycobacterium Tuberculosis in Complex with Hopoda

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 S114A Mutant of Hsad From Mycobacterium Tuberculosis in Complex with Hopoda within 5.0Å range:

probe	atom	residue	distance (Å)	B	Occ
B:Cl1289 b:0.7 occ:1.00	CL	B:KEK1289	0.0	0.7	1.0
	C02	B:KEK1289	1.8	75.3	1.0
	C09	B:KEK1289	2.7	72.1	1.0
	C07	B:KEK1289	2.8	69.7	1.0
	C03	B:KEK1289	2.9	78.5	1.0
	C19	B:KEK1289	2.9	48.5	1.0
	C08	B:KEK1289	3.1	58.3	1.0
	C11	B:KEK1289	3.1	56.5	1.0
	C10	B:KEK1289	3.4	61.0	1.0
	CD1	B:LEU158	3.6	51.5	1.0
	CG1	B:VAL243	3.9	24.1	1.0
	CG2	B:VAL155	4.0	21.0	1.0
	C06	B:KEK1289	4.3	77.1	1.0
	O	B:HOH2117	4.3	30.0	1.0
	C04	B:KEK1289	4.3	80.7	1.0
	O20	B:KEK1289	4.6	33.2	1.0
	C12	B:KEK1289	4.6	44.7	1.0
	CA	B:VAL155	4.7	17.4	1.0
	CG	B:LEU158	4.8	48.3	1.0
	CB	B:VAL155	4.8	19.9	1.0
	C05	B:KEK1289	4.8	83.5	1.0
	CB	B:LEU158	4.9	29.4	1.0

Reference:

N.A.Lack, K.C.Yam, E.D.Lowe, G.P.Horsman, R.L.Owen, E.Sim, L.D.Eltis. Characterization of A Carbon-Carbon Hydrolase From Mycobacterium Tuberculosis Involved in Cholesterol Metabolism. J. Biol. Chem. V. 285 434 2010.
ISSN: ESSN 1083-351X
PubMed: 19875455
DOI: 10.1074/JBC.M109.058081

Page generated: Fri Jul 11 01:41:47 2025

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