Chlorine in PDB 5scp: Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-23

Enzymatic activity of Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-23

All present enzymatic activity of Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-23:
1.5.1.3;

Protein crystallography data

The structure of Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-23, PDB code: 5scp was solved by Seattle Structural Genomics Center For Infectious Disease (Ssgcid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

*Resolution Low / High (Å)*	37.27 / 1.80
*Space group*	P 1 2₁ 1
*Cell size a, b, c (Å), α, β, γ (°)*	30.17, 66.68, 75.03, 90, 96.54, 90
*R / R_free (%)*	15.2 / 19.9

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-23 (pdb code 5scp). 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 Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-23, PDB code: 5scp:

Chlorine binding site 1 out of 1 in 5scp

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Chlorine Binding Sites List in 5scp

Chlorine binding site 1 out of 1 in the Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-23

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 Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-23 within 5.0Å range:

probe	atom	residue	distance (Å)	B	Occ
B:Cl204 b:23.7 occ:1.00	NE	B:ARG32	3.2	16.8	1.0
	O	B:HOH391	3.2	16.1	1.0
	O	B:HOH393	3.3	29.0	1.0
	NH2	B:ARG60	3.5	13.4	1.0
	CD	B:PRO58	3.8	15.8	1.0
	NH1	B:ARG32	3.9	15.4	1.0
	CB	B:PRO58	3.9	18.5	1.0
	CE	B:MET36	3.9	16.4	1.0
	CG	B:PRO58	4.0	19.4	1.0
	CZ	B:ARG32	4.0	14.6	1.0
	O	B:PRO58	4.0	17.6	1.0
	CD	B:ARG32	4.1	16.5	1.0
	N	B:PRO58	4.4	14.3	1.0
	C	B:PRO58	4.5	18.5	1.0
	CA	B:PRO58	4.5	14.8	1.0
	CZ	B:ARG60	4.7	14.5	1.0
	CG	B:ARG32	4.7	12.2	1.0
	O	B:HOH395	4.7	33.5	1.0
	O	B:HOH412	4.9	5.6	1.0

Reference:

S.J.Mayclin, J.W.Fairman, D.M.Dranow, D.G.Conrady, D.Fox Iii, C.M.Lukacs, D.D.Lorimer, P.S.Horanyi, T.E.Edwards, J.Abendroth. Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-23 To Be Published.

Page generated: Fri Jul 26 16:41:46 2024

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