Potassium in PDB 4x6j: Development of N-(Functionalized Benzoyl)-Homocycloleucyl- Glycinonitriles As Potent Cathepsin K Inhibitors.

Enzymatic activity of Development of N-(Functionalized Benzoyl)-Homocycloleucyl- Glycinonitriles As Potent Cathepsin K Inhibitors.

All present enzymatic activity of Development of N-(Functionalized Benzoyl)-Homocycloleucyl- Glycinonitriles As Potent Cathepsin K Inhibitors.:
3.4.22.38;

Protein crystallography data

The structure of Development of N-(Functionalized Benzoyl)-Homocycloleucyl- Glycinonitriles As Potent Cathepsin K Inhibitors., PDB code: 4x6j was solved by J.Borisek, B.Mohar, M.Vizovisek, P.Sosnowski, D.Turk, B.Turk, M.Novic, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

*Resolution Low / High (Å)*	45.99 / 1.59
*Space group*	P 1 2₁ 1
*Cell size a, b, c (Å), α, β, γ (°)*	47.219, 44.403, 51.354, 90.00, 116.42, 90.00
*R / R_free (%)*	18.3 / 23.8

Other elements in 4x6j:

The structure of Development of N-(Functionalized Benzoyl)-Homocycloleucyl- Glycinonitriles As Potent Cathepsin K Inhibitors. also contains other interesting chemical elements:

Chlorine

(Cl)

2 atoms

Potassium Binding Sites:

The binding sites of Potassium atom in the Development of N-(Functionalized Benzoyl)-Homocycloleucyl- Glycinonitriles As Potent Cathepsin K Inhibitors. (pdb code 4x6j). This binding sites where shown within 5.0 Angstroms radius around Potassium atom.
In total only one binding site of Potassium was determined in the Development of N-(Functionalized Benzoyl)-Homocycloleucyl- Glycinonitriles As Potent Cathepsin K Inhibitors., PDB code: 4x6j:

Potassium binding site 1 out of 1 in 4x6j

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Potassium Binding Sites List in 4x6j

Potassium binding site 1 out of 1 in the Development of N-(Functionalized Benzoyl)-Homocycloleucyl- Glycinonitriles As Potent Cathepsin K Inhibitors.

Mono view

Stereo pair view

A full contact list of Potassium with other atoms in the K binding site number 1 of Development of N-(Functionalized Benzoyl)-Homocycloleucyl- Glycinonitriles As Potent Cathepsin K Inhibitors. within 5.0Å range:

probe	atom	residue	distance (Å)	B	Occ
A:K303 b:37.6 occ:1.00	O	A:ALA197	2.8	16.0	1.0
	O	A:ALA203	2.8	14.7	1.0
	O	A:HOH551	2.9	17.6	1.0
	CB	A:MET196	3.4	12.4	1.0
	N	A:ALA197	3.5	16.0	1.0
	CB	A:ALA203	3.6	15.4	1.0
	C	A:ALA203	3.6	16.8	1.0
	C	A:ALA197	3.8	16.9	1.0
	C	A:MET196	3.8	14.0	1.0
	CE	A:MET196	3.8	14.0	1.0
	CB	A:ILE206	4.0	17.1	1.0
	CA	A:ALA203	4.1	16.2	1.0
	CA	A:ALA197	4.1	16.9	1.0
	CA	A:MET196	4.1	12.6	1.0
	CG2	A:ILE206	4.1	17.5	1.0
	O	A:HOH518	4.3	15.6	1.0
	O	A:MET196	4.3	14.2	1.0
	N	A:ALA203	4.4	16.9	1.0
	CB	A:ALA197	4.5	17.1	1.0
	CD1	A:TRP178	4.5	14.8	1.0
	CB	A:CYS204	4.5	18.6	1.0
	CG	A:MET196	4.5	12.6	1.0
	CG1	A:ILE206	4.5	21.0	1.0
	SD	A:MET196	4.6	12.6	1.0
	N	A:CYS204	4.6	16.7	1.0
	CD1	A:ILE206	4.7	21.6	1.0

Reference:

J.Borisek, M.Vizovisek, P.Sosnowski, B.Turk, D.Turk, B.Mohar, M.Novic. Development of N-(Functionalized Benzoyl)-Homocycloleucyl-Glycinonitriles As Potent Cathepsin K Inhibitors. J.Med.Chem. V. 58 6928 2015.
ISSN: ISSN 0022-2623
PubMed: 26280490
DOI: 10.1021/ACS.JMEDCHEM.5B00746

Page generated: Sat Aug 9 08:14:15 2025

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