Chlorine in PDB 5fdf: Crystal Structure of the Monoclinic Form of Thermotoga Maritima Acetyl Esterase TM0077 (Apo Structure) at 1.76 Angstrom Resolution

Enzymatic activity of Crystal Structure of the Monoclinic Form of Thermotoga Maritima Acetyl Esterase TM0077 (Apo Structure) at 1.76 Angstrom Resolution

All present enzymatic activity of Crystal Structure of the Monoclinic Form of Thermotoga Maritima Acetyl Esterase TM0077 (Apo Structure) at 1.76 Angstrom Resolution:
3.1.1.41; 3.1.1.72;

Protein crystallography data

The structure of Crystal Structure of the Monoclinic Form of Thermotoga Maritima Acetyl Esterase TM0077 (Apo Structure) at 1.76 Angstrom Resolution, PDB code: 5fdf was solved by N.Manoj, M.K.Singh, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

*Resolution Low / High (Å)*	39.96 / 1.76
*Space group*	P 1 2₁ 1
*Cell size a, b, c (Å), α, β, γ (°)*	89.760, 116.200, 103.290, 90.00, 109.97, 90.00
*R / R_free (%)*	16 / 19.5

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of the Monoclinic Form of Thermotoga Maritima Acetyl Esterase TM0077 (Apo Structure) at 1.76 Angstrom Resolution (pdb code 5fdf). 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 the Monoclinic Form of Thermotoga Maritima Acetyl Esterase TM0077 (Apo Structure) at 1.76 Angstrom Resolution, PDB code: 5fdf:

Chlorine binding site 1 out of 1 in 5fdf

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Chlorine Binding Sites List in 5fdf

Chlorine binding site 1 out of 1 in the Crystal Structure of the Monoclinic Form of Thermotoga Maritima Acetyl Esterase TM0077 (Apo Structure) at 1.76 Angstrom Resolution

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 the Monoclinic Form of Thermotoga Maritima Acetyl Esterase TM0077 (Apo Structure) at 1.76 Angstrom Resolution within 5.0Å range:

probe	atom	residue	distance (Å)	B	Occ
B:Cl401 b:34.5 occ:1.00	O	B:HOH519	3.0	29.5	1.0
	ND1	B:HIS100	3.1	23.0	1.0
	O	B:HOH750	3.2	32.6	1.0
	N	B:HIS100	3.3	18.3	1.0
	O	B:HOH612	3.4	32.8	1.0
	CB	B:HIS100	3.5	18.6	1.0
	CG	B:HIS100	3.7	20.3	1.0
	CD	B:PRO99	3.8	18.6	1.0
	N	B:PRO99	4.0	18.9	1.0
	CB	B:PRO99	4.0	19.3	1.0
	CA	B:HIS100	4.0	20.6	1.0
	CB	B:PHE98	4.2	24.4	1.0
	CG	B:PRO99	4.3	18.3	1.0
	C	B:PRO99	4.3	17.6	1.0
	CE1	B:HIS100	4.3	24.0	1.0
	CE	D:MET108	4.3	20.8	1.0
	CA	B:PRO99	4.3	17.1	1.0
	CG2	D:VAL312	4.7	32.2	1.0
	C	B:PHE98	4.7	18.6	1.0
	CD1	B:LEU51	4.7	21.3	1.0
	OG	B:SER49	4.7	26.4	1.0
	CG	B:LEU51	4.8	21.8	1.0
	CD2	B:PHE98	5.0	30.9	1.0
	CA	B:PHE98	5.0	21.6	1.0

Reference:

M.K.Singh, N.Manoj. An Extended Loop in CE7 Carbohydrate Esterase Family Is Dispensable For Oligomerization But Required For Activity and Thermostability. J.Struct.Biol. V. 194 434 2016.
ISSN: ESSN 1095-8657
PubMed: 27085421
DOI: 10.1016/J.JSB.2016.04.008

Page generated: Sat Jul 12 02:01:29 2025

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