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Chlorine in PDB 3s1y: Amp-C Beta-Lactamase (Pseudomonas Aeruginosa) in Complex with A Beta- Lactamase Inhibitor

Enzymatic activity of Amp-C Beta-Lactamase (Pseudomonas Aeruginosa) in Complex with A Beta- Lactamase Inhibitor

All present enzymatic activity of Amp-C Beta-Lactamase (Pseudomonas Aeruginosa) in Complex with A Beta- Lactamase Inhibitor:
3.5.2.6;

Protein crystallography data

The structure of Amp-C Beta-Lactamase (Pseudomonas Aeruginosa) in Complex with A Beta- Lactamase Inhibitor, PDB code: 3s1y was solved by G.Scapin, J.Lu, P.M.D.Fitzgerald, N.Sharma, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 30.00 / 1.40
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 43.253, 69.696, 101.667, 90.00, 90.00, 90.00
R / Rfree (%) 18.1 / 20.2

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Amp-C Beta-Lactamase (Pseudomonas Aeruginosa) in Complex with A Beta- Lactamase Inhibitor (pdb code 3s1y). 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 Amp-C Beta-Lactamase (Pseudomonas Aeruginosa) in Complex with A Beta- Lactamase Inhibitor, PDB code: 3s1y:

Chlorine binding site 1 out of 1 in 3s1y

Go back to Chlorine Binding Sites List in 3s1y
Chlorine binding site 1 out of 1 in the Amp-C Beta-Lactamase (Pseudomonas Aeruginosa) in Complex with A Beta- Lactamase Inhibitor


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Amp-C Beta-Lactamase (Pseudomonas Aeruginosa) in Complex with A Beta- Lactamase Inhibitor within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl399

b:19.1
occ:1.00
 O A:HOH1032 2.9 10.8 1.0
N A:PHE147 3.3 11.6 1.0
ND2 A:ASN179 3.4 11.2 1.0
CB A:ASN179 3.4 9.2 1.0
CA A:GLN146 3.6 11.8 1.0
O A:HOH1116 3.6 21.7 1.0
CD2 A:PHE147 3.7 10.0 1.0
O A:HOH1235 3.7 52.6 1.0
CB A:GLN146 3.7 12.4 1.0
CE2 A:TYR249 3.7 9.2 1.0
CG A:ASN179 3.9 10.4 1.0
C A:GLN146 3.9 11.5 1.0
CG A:GLN146 4.1 14.5 1.0
CB A:PHE147 4.2 11.6 1.0
C24 A:S1Y398 4.3 10.7 1.0
CA A:PHE147 4.3 11.7 1.0
CD A:PRO180 4.4 8.5 1.0
O A:PRO243 4.4 6.7 1.0
CG A:PHE147 4.4 10.3 1.0
C25 A:S1Y398 4.5 10.4 1.0
CD2 A:TYR249 4.5 9.6 1.0
OH A:TYR249 4.5 9.8 1.0
CZ A:TYR249 4.6 9.2 1.0
CE2 A:PHE147 4.6 9.8 1.0
O A:LEU145 4.7 10.5 1.0
CA A:ASN179 4.8 9.0 1.0
O A:PHE147 4.8 12.4 1.0
N A:GLN146 4.9 11.1 1.0
N A:PRO180 4.9 8.6 1.0

Reference:

H.Chen, T.A.Blizzard, S.Kim, J.Wu, K.Young, Y.W.Park, A.M.Ogawa, S.Raghoobar, R.E.Painter, D.Wisniewski, N.Hairston, P.Fitzgerald, N.Sharma, G.Scapin, J.Lu, J.Hermes, M.L.Hammond. Side Chain Sar of Bicyclic Beta-Lactamase Inhibitors (Blis). 2. N-Alkylated and Open Chain Analogs of Mk-8712 Bioorg.Med.Chem.Lett. V. 21 4267 2011.
ISSN: ISSN 0960-894X
PubMed: 21676616
DOI: 10.1016/J.BMCL.2011.05.065
Page generated: Sun Jul 21 04:05:20 2024

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