Chlorine in PDB 7rn1: Crystal Structure of the Sars-Cov-2 (Covid-19) Main Protease in Complex with Inhibitor JUN9-62-2R

Enzymatic activity of Crystal Structure of the Sars-Cov-2 (Covid-19) Main Protease in Complex with Inhibitor JUN9-62-2R

All present enzymatic activity of Crystal Structure of the Sars-Cov-2 (Covid-19) Main Protease in Complex with Inhibitor JUN9-62-2R:
3.4.22.69;

Protein crystallography data

The structure of Crystal Structure of the Sars-Cov-2 (Covid-19) Main Protease in Complex with Inhibitor JUN9-62-2R, PDB code: 7rn1 was solved by M.Sacco, Y.Chen, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

*Resolution Low / High (Å)*	48.00 / 2.30
*Space group*	C 1 2 1
*Cell size a, b, c (Å), α, β, γ (°)*	114.27, 53.26, 45.46, 90, 102.82, 90
*R / R_free (%)*	19.8 / 22.3

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of the Sars-Cov-2 (Covid-19) Main Protease in Complex with Inhibitor JUN9-62-2R (pdb code 7rn1). 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 Sars-Cov-2 (Covid-19) Main Protease in Complex with Inhibitor JUN9-62-2R, PDB code: 7rn1:

Chlorine binding site 1 out of 1 in 7rn1

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Chlorine Binding Sites List in 7rn1

Chlorine binding site 1 out of 1 in the Crystal Structure of the Sars-Cov-2 (Covid-19) Main Protease in Complex with Inhibitor JUN9-62-2R

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 Sars-Cov-2 (Covid-19) Main Protease in Complex with Inhibitor JUN9-62-2R within 5.0Å range:

probe	atom	residue	distance (Å)	B	Occ
A:Cl503 b:51.9 occ:1.00	CL35	A:5ZF503	0.0	51.9	1.0
	C34	A:5ZF503	1.8	37.9	1.0
	C02	A:5ZF503	2.6	36.8	1.0
	O01	A:5ZF503	2.6	35.0	1.0
	SG	A:CYS145	2.9	32.8	1.0
	N	A:GLY143	3.2	37.2	1.0
	CA	A:GLY143	3.2	35.8	1.0
	N	A:CYS145	3.4	31.7	1.0
	C	A:GLY143	3.4	33.0	1.0
	CB	A:CYS145	3.6	31.3	1.0
	N	A:SER144	3.7	32.2	1.0
	N03	A:5ZF503	3.9	33.5	1.0
	O	A:GLY143	4.0	33.6	1.0
	CA	A:CYS145	4.1	31.9	1.0
	CB	A:LEU27	4.4	34.0	1.0
	C	A:ASN142	4.4	38.6	1.0
	C04	A:5ZF503	4.5	37.3	1.0
	C	A:SER144	4.5	28.4	1.0
	CA	A:SER144	4.7	29.8	1.0
	O	A:CYS145	4.7	34.7	1.0
	C05	A:5ZF503	4.9	37.2	1.0
	O	A:THR26	4.9	38.7	1.0
	C	A:CYS145	4.9	31.9	1.0
	CA	A:ASN142	4.9	41.3	1.0
	C16	A:5ZF503	5.0	36.1	1.0

Reference:

M.Sacco, M.Sacco, Y.Chen. N/A N/A.

Page generated: Sun Jul 13 06:45:08 2025

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