Chlorine in PDB 7p2n: E.Coli GYRB24 with Inhibitor LSJ38 (EBL2684)

All present enzymatic activity of E.Coli GYRB24 with Inhibitor LSJ38 (EBL2684):
5.6.2.2;

The structure of E.Coli GYRB24 with Inhibitor LSJ38 (EBL2684), PDB code: 7p2n was solved by C.E.M.Stevenson, D.M.Lawson, A.M.Maxwell, S.R.Henderson, D.Kikelj, A.Zega, N.Zidar, J.Ilas, T.Tomasic, L.P.Masic, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	33.94 / 1.16
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	76.606, 50.326, 52.652, 90, 102.41, 90
R / Rfree (%)	14.2 / 17

The binding sites of Chlorine atom in the E.Coli GYRB24 with Inhibitor LSJ38 (EBL2684) (pdb code 7p2n). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the E.Coli GYRB24 with Inhibitor LSJ38 (EBL2684), PDB code: 7p2n:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the E.Coli GYRB24 with Inhibitor LSJ38 (EBL2684)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of E.Coli GYRB24 with Inhibitor LSJ38 (EBL2684) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl302 b:10.7 occ:1.00 CL1 A:4R3302 0.0 10.7 1.0 C12 A:4R3302 1.7 10.0 1.0 C13 A:4R3302 2.7 9.2 1.0 C11 A:4R3302 2.8 9.9 1.0 CL2 A:4R3302 3.4 12.1 1.0 C14 A:4R3302 3.4 10.4 1.0 CG2 A:VAL120 3.6 16.6 1.0 CB A:ASN46 3.7 11.3 1.0 N3 A:4R3302 3.9 9.8 1.0 C10 A:4R3302 3.9 9.9 1.0 CG2 A:VAL167 3.9 9.6 1.0 CB A:VAL120 3.9 14.9 1.0 CG1 A:VAL43 4.0 9.7 1.0 CG A:ASN46 4.1 13.7 1.0 ND2 A:ASN46 4.2 15.5 1.0 O A:VAL43 4.2 10.0 1.0 CG1 A:VAL120 4.4 14.2 1.0 CA A:VAL43 4.5 9.2 1.0 CB A:VAL167 4.7 8.7 1.0 CB A:VAL43 4.7 9.2 1.0 OD1 A:ASN46 4.7 21.7 1.0 C A:VAL43 4.9 9.5 1.0 CG2 A:THR165 5.0 8.9 1.0

Chlorine binding site 2 out of 2 in the E.Coli GYRB24 with Inhibitor LSJ38 (EBL2684)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of E.Coli GYRB24 with Inhibitor LSJ38 (EBL2684) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl302 b:12.1 occ:1.00 CL2 A:4R3302 0.0 12.1 1.0 C11 A:4R3302 1.7 9.9 1.0 C12 A:4R3302 2.7 10.0 1.0 C10 A:4R3302 2.8 9.9 1.0 N2 A:4R3302 3.2 10.7 1.0 CL1 A:4R3302 3.4 10.7 1.0 C9 A:4R3302 3.5 10.1 1.0 CD1 A:ILE78 3.6 11.6 1.0 OD1 A:ASN46 3.7 21.7 1.0 O A:HOH529 3.8 20.5 1.0 N3 A:4R3302 3.9 9.8 1.0 C13 A:4R3302 3.9 9.2 1.0 CB A:ASN46 3.9 11.3 1.0 CG1 A:ILE78 4.0 10.4 1.0 CG A:ASN46 4.0 13.7 1.0 C7 A:4R3302 4.3 10.7 1.0 CG1 A:VAL120 4.3 14.2 1.0 CG2 A:ILE94 4.4 15.4 1.0 O A:HOH494 4.4 34.9 1.0 O A:HOH488 4.6 26.2 1.0 N1 A:4R3302 4.7 11.3 1.0 O4 A:4R3302 4.7 12.8 1.0 CB A:VAL120 4.9 14.9 1.0 ND2 A:ASN46 4.9 15.5 1.0

C.E.M.Stevenson, D.M.Lawson, A.M.Maxwell, S.R.Henderson, D.Kikelj, A.Zega, N.Zidar, J.Ilas, T.Tomasic, L.P.Masic. E.Coli GYRB24 with Inhibitor LSJ38 (EBL2684) To Be Published.