Zinc in PDB 7nlm: Lasb, N-Aryl-2-Butylmercaptoacetamide

The structure of Lasb, N-Aryl-2-Butylmercaptoacetamide, PDB code: 7nlm was solved by J.Koehnke, A.Sikandar, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	44.97 / 1.65
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	40.703, 89.931, 41.245, 90, 114.34, 90
R / Rfree (%)	17.8 / 20.3

The structure of Lasb, N-Aryl-2-Butylmercaptoacetamide also contains other interesting chemical elements:

Calcium

(Ca)

1 atom

The binding sites of Zinc atom in the Lasb, N-Aryl-2-Butylmercaptoacetamide (pdb code 7nlm). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total only one binding site of Zinc was determined in the Lasb, N-Aryl-2-Butylmercaptoacetamide, PDB code: 7nlm:

Zinc binding site 1 out of 1 in the Lasb, N-Aryl-2-Butylmercaptoacetamide


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Lasb, N-Aryl-2-Butylmercaptoacetamide within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn301 b:11.2 occ:1.00 OE2 A:GLU164 1.9 12.9 1.0 NE2 A:HIS140 2.2 13.6 1.0 NE2 A:HIS144 2.2 13.5 1.0 S11 A:UHE300 2.5 22.7 1.0 CD A:GLU164 2.8 14.4 1.0 OE1 A:GLU164 3.1 14.4 1.0 CD2 A:HIS140 3.1 14.7 1.0 CD2 A:HIS144 3.1 13.0 1.0 CE1 A:HIS144 3.2 12.1 1.0 CE1 A:HIS140 3.2 11.8 1.0 C10 A:UHE300 3.4 31.4 1.0 OH A:TYR155 3.8 17.2 1.0 OE1 A:GLU141 4.1 19.4 1.0 CG A:GLU164 4.2 12.5 1.0 CG A:HIS140 4.3 11.1 1.0 ND1 A:HIS140 4.3 11.6 1.0 ND1 A:HIS144 4.3 13.9 1.0 CG A:HIS144 4.3 13.0 1.0 C08 A:UHE300 4.4 28.5 1.0 NE2 A:HIS223 4.4 18.8 1.0 O A:HOH515 4.4 34.6 1.0 O A:HOH610 4.5 30.1 1.0 C12 A:UHE300 4.6 31.9 1.0 CB A:SER167 4.6 10.0 1.0 CZ A:TYR155 4.7 16.5 1.0 O09 A:UHE300 4.8 28.6 1.0 CD2 A:HIS223 4.8 18.5 1.0 CA A:GLU164 4.8 10.5 1.0 CE1 A:TYR155 4.8 15.8 1.0 OG A:SER167 4.9 10.5 1.0 CB A:GLU164 5.0 9.8 1.0

J.Koehnke, A.Sikandar. Lasb, N-Aryl-2-Butylmercaptoacetamide Inhibitor Complex To Be Published.