Chlorine in PDB 4gp1: Crystal Structure of Isoprenoid Synthase A3MSH1 (Target Efi-501992) From Pyrobaculum Calidifontis Complexed with Dmapp

The structure of Crystal Structure of Isoprenoid Synthase A3MSH1 (Target Efi-501992) From Pyrobaculum Calidifontis Complexed with Dmapp, PDB code: 4gp1 was solved by Y.Patskovsky, R.Toro, R.Bhosle, B.Hillerich, R.D.Seidel, E.Washington, A.Scott Glenn, S.Chowdhury, B.Evans, J.Hammonds, W.D.Zencheck, H.J.Imker, C.D.Poulter, J.A.Gerlt, S.C.Almo, Enzyme Function Initiative (Efi), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	44.74 / 1.94
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	60.598, 89.393, 148.806, 90.00, 90.00, 90.00
R / Rfree (%)	17.2 / 21.5

The binding sites of Chlorine atom in the Crystal Structure of Isoprenoid Synthase A3MSH1 (Target Efi-501992) From Pyrobaculum Calidifontis Complexed with Dmapp (pdb code 4gp1). 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 Isoprenoid Synthase A3MSH1 (Target Efi-501992) From Pyrobaculum Calidifontis Complexed with Dmapp, PDB code: 4gp1:

Chlorine binding site 1 out of 1 in the Crystal Structure of Isoprenoid Synthase A3MSH1 (Target Efi-501992) From Pyrobaculum Calidifontis Complexed with Dmapp


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 Isoprenoid Synthase A3MSH1 (Target Efi-501992) From Pyrobaculum Calidifontis Complexed with Dmapp within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl401 b:41.6 occ:1.00 N A:TRP64 3.1 26.0 1.0 N A:ARG65 3.1 24.1 1.0 O A:HOH607 3.2 39.8 1.0 CG A:ARG65 3.6 31.5 1.0 CA A:GLN63 3.6 27.8 1.0 CB A:ARG65 3.7 28.2 1.0 CD1 A:TRP64 3.7 26.4 1.0 CB A:GLN63 3.7 21.0 1.0 C A:GLN63 3.8 24.6 1.0 CD A:ARG65 3.9 35.6 1.0 NE1 A:TRP64 3.9 30.7 1.0 CG A:GLN63 4.0 33.0 1.0 CA A:ARG65 4.0 28.7 1.0 CG A:TRP64 4.0 30.6 1.0 CA A:TRP64 4.0 30.3 1.0 C A:TRP64 4.1 31.4 1.0 NE A:ARG65 4.2 35.9 1.0 CD A:PRO66 4.3 25.2 1.0 CE2 A:TRP64 4.4 32.4 1.0 CD2 A:TRP64 4.5 29.7 1.0 CB A:TRP64 4.6 26.6 1.0 CD A:GLN63 4.8 51.6 1.0 O A:GLN63 4.9 25.2 1.0 O A:GLY62 4.9 28.6 1.0 N A:GLN63 5.0 24.8 1.0

Y.Patskovsky, R.Toro, R.Bhosle, B.Hillerich, R.D.Seidel, E.Washington, A.Scott Glenn, S.Chowdury, B.Evans, J.Hammonds, W.D.Zencheck, H.J.Imker, C.D.Poulter, J.A.Gerlt, S.C.Almo. Crystal Structure of Isoprenoid Synthase From Pyrobaculum Calidifontis To Be Published.