Atomistry » Fluorine » PDB 461d-4azy » 4a3h
Atomistry »
  Fluorine »
    PDB 461d-4azy »
      4a3h »

Fluorine in PDB 4a3h: 2',4' Dinitrophenyl-2-Deoxy-2-Fluro-B-D-Cellobioside Complex of the Endoglucanase CEL5A From Bacillus Agaradhaerens at 1.6 A Resolution

Enzymatic activity of 2',4' Dinitrophenyl-2-Deoxy-2-Fluro-B-D-Cellobioside Complex of the Endoglucanase CEL5A From Bacillus Agaradhaerens at 1.6 A Resolution

All present enzymatic activity of 2',4' Dinitrophenyl-2-Deoxy-2-Fluro-B-D-Cellobioside Complex of the Endoglucanase CEL5A From Bacillus Agaradhaerens at 1.6 A Resolution:
3.2.1.4;

Protein crystallography data

The structure of 2',4' Dinitrophenyl-2-Deoxy-2-Fluro-B-D-Cellobioside Complex of the Endoglucanase CEL5A From Bacillus Agaradhaerens at 1.6 A Resolution, PDB code: 4a3h was solved by G.J.Davies, A.M.Brzozowski, K.Andersen, M.Schulein, L.Mackenzie, S.G.Withers, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 15.00 / 1.65
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 54.710, 69.570, 77.040, 90.00, 90.00, 90.00
R / Rfree (%) 14.2 / 17.2

Fluorine Binding Sites:

The binding sites of Fluorine atom in the 2',4' Dinitrophenyl-2-Deoxy-2-Fluro-B-D-Cellobioside Complex of the Endoglucanase CEL5A From Bacillus Agaradhaerens at 1.6 A Resolution (pdb code 4a3h). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total only one binding site of Fluorine was determined in the 2',4' Dinitrophenyl-2-Deoxy-2-Fluro-B-D-Cellobioside Complex of the Endoglucanase CEL5A From Bacillus Agaradhaerens at 1.6 A Resolution, PDB code: 4a3h:

Fluorine binding site 1 out of 1 in 4a3h

Go back to Fluorine Binding Sites List in 4a3h
Fluorine binding site 1 out of 1 in the 2',4' Dinitrophenyl-2-Deoxy-2-Fluro-B-D-Cellobioside Complex of the Endoglucanase CEL5A From Bacillus Agaradhaerens at 1.6 A Resolution


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of 2',4' Dinitrophenyl-2-Deoxy-2-Fluro-B-D-Cellobioside Complex of the Endoglucanase CEL5A From Bacillus Agaradhaerens at 1.6 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F304

b:16.2
occ:1.00
 F2A A:DCB304 0.0 16.2 1.0
C2A A:DCB304 1.4 20.1 1.0
C1A A:DCB304 2.3 26.0 1.0
C3A A:DCB304 2.3 18.5 1.0
OE2 A:GLU228 2.7 20.3 1.0
O3A A:DCB304 3.0 14.9 1.0
ND2 A:ASN138 3.0 13.6 1.0
OE1 A:GLU228 3.1 12.7 1.0
OE1 A:GLU139 3.1 16.6 1.0
CD A:GLU139 3.2 13.8 1.0
O5A A:DCB304 3.2 24.0 1.0
OE2 A:GLU139 3.2 13.7 1.0
CD A:GLU228 3.3 19.1 1.0
O1A A:DCB304 3.3 24.7 1.0
NE2 A:HIS101 3.4 11.8 1.0
CE1 A:HIS101 3.5 11.8 1.0
C4A A:DCB304 3.6 22.1 1.0
OD1 A:ASN138 3.7 12.1 1.0
CG A:ASN138 3.8 12.7 1.0
C5A A:DCB304 3.9 23.8 1.0
CG A:GLU139 4.0 13.2 1.0
CD1 A:LEU103 4.3 17.2 1.0
C1 A:DCB304 4.5 23.8 1.0
CD2 A:HIS101 4.5 11.3 1.0
ND1 A:HIS101 4.6 11.2 1.0
CB A:GLU139 4.6 11.3 1.0
O4A A:DCB304 4.7 20.4 1.0
CG A:GLU228 4.8 12.6 1.0
CD2 A:LEU103 4.8 17.1 1.0
C2 A:DCB304 4.9 24.9 1.0
ND1 A:HIS200 4.9 12.7 1.0

Reference:

G.J.Davies, L.Mackenzie, A.Varrot, M.Dauter, A.M.Brzozowski, M.Schulein, S.G.Withers. Snapshots Along An Enzymatic Reaction Coordinate: Analysis of A Retaining Beta-Glycoside Hydrolase. Biochemistry V. 37 11707 1998.
ISSN: ISSN 0006-2960
PubMed: 9718293
DOI: 10.1021/BI981315I
Page generated: Sun Dec 13 11:58:31 2020

Last articles

Zn in 8WB0
Zn in 8WAX
Zn in 8WAU
Zn in 8WAZ
Zn in 8WAY
Zn in 8WAV
Zn in 8WAW
Zn in 8WAT
Zn in 8W7M
Zn in 8WD3
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy