Chlorine in PDB 3qbe: Crystal Structure of the 3-Dehydroquinate Synthase (Arob) From Mycobacterium Tuberculosis

Enzymatic activity of Crystal Structure of the 3-Dehydroquinate Synthase (Arob) From Mycobacterium Tuberculosis

All present enzymatic activity of Crystal Structure of the 3-Dehydroquinate Synthase (Arob) From Mycobacterium Tuberculosis:
4.2.3.4;

Protein crystallography data

The structure of Crystal Structure of the 3-Dehydroquinate Synthase (Arob) From Mycobacterium Tuberculosis, PDB code: 3qbe was solved by W.C.Cheng, Y.H.Wen, W.C.Wang, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

*Resolution Low / High (Å)*	30.00 / 2.07
*Space group*	I 4₁
*Cell size a, b, c (Å), α, β, γ (°)*	140.318, 140.318, 38.408, 90.00, 90.00, 90.00
*R / R_free (%)*	20.1 / 24.8

Other elements in 3qbe:

The structure of Crystal Structure of the 3-Dehydroquinate Synthase (Arob) From Mycobacterium Tuberculosis also contains other interesting chemical elements:

Zinc

(Zn)

2 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of the 3-Dehydroquinate Synthase (Arob) From Mycobacterium Tuberculosis (pdb code 3qbe). 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 the 3-Dehydroquinate Synthase (Arob) From Mycobacterium Tuberculosis, PDB code: 3qbe:

Chlorine binding site 1 out of 1 in 3qbe

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Chlorine Binding Sites List in 3qbe

Chlorine binding site 1 out of 1 in the Crystal Structure of the 3-Dehydroquinate Synthase (Arob) From Mycobacterium Tuberculosis

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 the 3-Dehydroquinate Synthase (Arob) From Mycobacterium Tuberculosis within 5.0Å range:

probe	atom	residue	distance (Å)	B	Occ
A:Cl500 b:51.4 occ:1.00	ZN	A:ZN401	3.4	63.1	1.0
	NE2	A:GLN45	3.5	24.9	1.0
	CA	A:GLY106	3.8	25.4	1.0
	N	A:GLY107	3.9	26.1	1.0
	N	A:ALA108	3.9	26.3	1.0
	C	A:GLY106	3.9	26.2	1.0
	CB	A:ALA108	4.0	25.7	1.0
	CA	A:ALA74	4.1	31.6	1.0
	OE1	A:GLN45	4.3	29.5	1.0
	CD	A:GLN45	4.3	29.8	1.0
	N	A:GLY106	4.4	24.0	1.0
	CA	A:ALA108	4.6	26.0	1.0
	CB	A:ALA74	4.6	32.4	1.0
	O	A:GLY106	4.6	27.3	1.0
	N	A:ALA74	4.6	32.3	1.0
	C	A:ALA74	4.7	31.4	1.0
	CA	A:GLY107	4.8	26.3	1.0
	C	A:GLY107	4.8	27.3	1.0
	O	A:ALA74	5.0	31.4	1.0

Reference:

W.C.Cheng, T.J.Chen, W.C.Wang. Crystal Structure of the 3-Dehydroquinate Synthase (Arob) From Mycobacterium Tuberculosis To Be Published.

Page generated: Sun Jul 21 02:49:13 2024

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