Chlorine in PDB 3r8d: Activation of the Human Nuclear Xenobiotic Receptor Pxr By the Reverse Transcriptase-Targeted Anti-Hiv Drug Pnu-142721

Enzymatic activity of Activation of the Human Nuclear Xenobiotic Receptor Pxr By the Reverse Transcriptase-Targeted Anti-Hiv Drug Pnu-142721

All present enzymatic activity of Activation of the Human Nuclear Xenobiotic Receptor Pxr By the Reverse Transcriptase-Targeted Anti-Hiv Drug Pnu-142721:
2.3.1.48;

Protein crystallography data

The structure of Activation of the Human Nuclear Xenobiotic Receptor Pxr By the Reverse Transcriptase-Targeted Anti-Hiv Drug Pnu-142721, PDB code: 3r8d was solved by Y.Cheng, M.R.Redinbo, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

*Resolution Low / High (Å)*	41.27 / 2.80
*Space group*	P 4₃ 2₁ 2
*Cell size a, b, c (Å), α, β, γ (°)*	92.284, 92.284, 84.380, 90.00, 90.00, 90.00
*R / R_free (%)*	23.8 / 28.9

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Activation of the Human Nuclear Xenobiotic Receptor Pxr By the Reverse Transcriptase-Targeted Anti-Hiv Drug Pnu-142721 (pdb code 3r8d). 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 Activation of the Human Nuclear Xenobiotic Receptor Pxr By the Reverse Transcriptase-Targeted Anti-Hiv Drug Pnu-142721, PDB code: 3r8d:

Chlorine binding site 1 out of 1 in 3r8d

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Chlorine Binding Sites List in 3r8d

Chlorine binding site 1 out of 1 in the Activation of the Human Nuclear Xenobiotic Receptor Pxr By the Reverse Transcriptase-Targeted Anti-Hiv Drug Pnu-142721

Mono view

Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Activation of the Human Nuclear Xenobiotic Receptor Pxr By the Reverse Transcriptase-Targeted Anti-Hiv Drug Pnu-142721 within 5.0Å range:

probe	atom	residue	distance (Å)	B	Occ
A:Cl1 b:75.7 occ:1.00	CL19	A:PNU1	0.0	75.7	1.0
	C5	A:PNU1	1.7	73.0	1.0
	N6	A:PNU1	2.7	72.9	1.0
	C4	A:PNU1	2.7	72.0	1.0
	OG	A:SER247	3.5	50.0	1.0
	SD	A:MET425	3.6	44.6	1.0
	CD2	A:LEU411	3.9	53.9	1.0
	C1	A:PNU1	3.9	73.3	1.0
	CD1	A:LEU411	4.0	49.6	1.0
	C3	A:PNU1	4.0	73.3	1.0
	CB	A:SER247	4.1	39.0	1.0
	N2	A:PNU1	4.4	71.2	1.0
	CE1	A:PHE420	4.5	40.0	1.0
	CG	A:LEU411	4.5	51.4	1.0
	CE	A:MET425	4.7	38.1	1.0
	NE2	A:HIS407	4.9	55.3	1.0
	CE1	A:PHE429	5.0	55.2	1.0

Reference:

Y.Cheng, M.R.Redinbo. Activation of the Human Nuclear Xenobiotic Receptor Pxr By the Reverse Transcriptase-Targeted Anti-Hiv Drug Pnu-142721. Protein Sci. V. 20 1713 2011.
ISSN: ISSN 0961-8368
PubMed: 21805522
DOI: 10.1002/PRO.706

Page generated: Fri Jul 11 09:45:14 2025

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