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Fluorine in PDB 6q7v: Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11

Protein crystallography data

The structure of Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11, PDB code: 6q7v was solved by F.Witzgall, W.Blankenfeldt, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 46.65 / 2.56
Space group C 2 2 21
Cell size a, b, c (Å), α, β, γ (°) 109.380, 119.310, 114.408, 90.00, 90.00, 90.00
R / Rfree (%) 21.5 / 24.4

Fluorine Binding Sites:

The binding sites of Fluorine atom in the Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11 (pdb code 6q7v). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 8 binding sites of Fluorine where determined in the Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11, PDB code: 6q7v:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;

Fluorine binding site 1 out of 8 in 6q7v

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Fluorine binding site 1 out of 8 in the Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F400

b:90.4
occ:1.00
F13 A:HLK400 0.0 90.4 1.0
C12 A:HLK400 1.4 95.0 1.0
C14 A:HLK400 2.4 93.5 1.0
C11 A:HLK400 2.4 98.7 1.0
H141 A:HLK400 2.5 0.4 1.0
H111 A:HLK400 2.6 0.6 1.0
HD13 A:ILE263 2.8 77.6 1.0
HD12 A:ILE263 3.5 77.6 1.0
HG21 A:VAL170 3.5 57.9 1.0
CD1 A:ILE263 3.5 64.4 1.0
HG23 A:VAL170 3.6 57.9 1.0
C15 A:HLK400 3.6 91.1 1.0
HD11 A:ILE186 3.6 99.7 1.0
C10 A:HLK400 3.7 95.9 1.0
HD13 A:ILE186 3.7 99.7 1.0
CG2 A:VAL170 3.9 48.1 1.0
HG22 A:VAL170 3.9 57.9 1.0
HD11 A:ILE263 3.9 77.6 1.0
HD13 A:ILE236 4.1 58.0 1.0
HE1 A:TYR258 4.1 71.3 1.0
C09 A:HLK400 4.1 88.7 1.0
CD1 A:ILE186 4.1 82.9 1.0
HG21 A:ILE263 4.2 56.4 1.0
CE1 A:TYR258 4.2 59.2 1.0
HD1 A:TYR258 4.2 62.5 1.0
CD1 A:TYR258 4.3 51.9 1.0
H151 A:HLK400 4.4 0.5 1.0
H101 A:HLK400 4.4 0.4 1.0
HG12 A:ILE236 4.5 55.4 1.0
HG12 A:ILE186 4.5 0.7 1.0
HD11 A:ILE236 4.6 58.0 1.0
CG1 A:ILE263 4.7 66.9 1.0
CD1 A:ILE236 4.7 48.1 1.0
HG12 A:ILE263 4.8 80.6 1.0
CZ A:TYR258 4.9 58.3 1.0
HD12 A:ILE186 4.9 99.7 1.0
CG1 A:ILE186 5.0 93.7 1.0
CG A:TYR258 5.0 45.8 1.0

Fluorine binding site 2 out of 8 in 6q7v

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Fluorine binding site 2 out of 8 in the Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F400

b:58.8
occ:1.00
F18 A:HLK400 0.0 58.8 1.0
C17 A:HLK400 1.4 53.8 1.0
F20 A:HLK400 2.2 58.3 1.0
F19 A:HLK400 2.2 59.6 1.0
C04 A:HLK400 2.4 41.1 1.0
H051 A:HLK400 2.4 57.4 1.0
HB2 A:ALA168 2.5 39.7 1.0
C05 A:HLK400 2.7 47.6 1.0
HB1 A:ALA168 2.9 39.7 1.0
CB A:ALA168 3.1 32.9 1.0
HA A:PRO238 3.4 48.9 1.0
HG22 A:ILE236 3.5 62.2 1.0
N03 A:HLK400 3.5 44.2 1.0
HG3 A:PRO238 3.6 57.3 1.0
HB3 A:ALA168 3.7 39.7 1.0
HD13 A:ILE149 3.7 57.5 1.0
HB1 A:ALA102 3.8 52.1 1.0
N A:PRO238 3.9 34.3 1.0
C A:ALA237 4.0 34.4 1.0
C06 A:HLK400 4.1 58.7 1.0
CA A:PRO238 4.1 40.5 1.0
HA A:ALA168 4.1 47.9 1.0
HD3 A:PRO238 4.1 52.0 1.0
O A:ALA237 4.2 42.9 1.0
HB2 A:ALA102 4.2 52.1 1.0
HG1 A:THR265 4.2 51.0 1.0
CA A:ALA168 4.2 39.7 1.0
CG A:PRO238 4.3 47.5 1.0
CG2 A:ILE236 4.3 51.6 1.0
HZ A:PHE221 4.3 37.0 1.0
CD A:PRO238 4.4 43.1 1.0
HD11 A:ILE149 4.4 57.5 1.0
HB3 A:PRO238 4.4 56.8 1.0
CD1 A:ILE149 4.4 47.7 1.0
HG21 A:ILE236 4.5 62.2 1.0
CB A:ALA102 4.5 43.2 1.0
HA A:ALA237 4.5 42.7 1.0
HG23 A:ILE236 4.5 62.2 1.0
CB A:PRO238 4.5 47.1 1.0
C02 A:HLK400 4.6 50.7 1.0
HD12 A:ILE149 4.7 57.5 1.0
CA A:ALA237 4.7 35.4 1.0
O A:LYS167 4.8 59.0 1.0
H071 A:HLK400 4.9 80.3 1.0
C16 A:HLK400 4.9 58.3 1.0
HG21 A:THR265 4.9 55.5 1.0
N A:ALA237 4.9 43.6 1.0
O A:ILE236 5.0 51.3 1.0
CZ A:PHE221 5.0 30.7 1.0
N07 A:HLK400 5.0 66.7 1.0

Fluorine binding site 3 out of 8 in 6q7v

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Fluorine binding site 3 out of 8 in the Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 3 of Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F400

b:59.6
occ:1.00
F19 A:HLK400 0.0 59.6 1.0
C17 A:HLK400 1.4 53.8 1.0
F18 A:HLK400 2.2 58.8 1.0
F20 A:HLK400 2.2 58.3 1.0
C04 A:HLK400 2.4 41.1 1.0
N03 A:HLK400 2.7 44.2 1.0
HZ A:PHE221 2.8 37.0 1.0
HG22 A:ILE236 2.9 62.2 1.0
HE2 A:PHE221 3.0 35.1 1.0
O A:ILE236 3.2 51.3 1.0
HD3 A:PRO238 3.2 52.0 1.0
HA A:ALA237 3.2 42.7 1.0
CZ A:PHE221 3.4 30.7 1.0
CE2 A:PHE221 3.5 29.0 1.0
C05 A:HLK400 3.6 47.6 1.0
HG3 A:PRO238 3.7 57.3 1.0
C A:ILE236 3.7 46.0 1.0
CG2 A:ILE236 3.8 51.6 1.0
CA A:ALA237 3.8 35.4 1.0
H051 A:HLK400 3.9 57.4 1.0
C A:ALA237 3.9 34.4 1.0
CD A:PRO238 3.9 43.1 1.0
N A:PRO238 3.9 34.3 1.0
N A:ALA237 4.0 43.6 1.0
C02 A:HLK400 4.0 50.7 1.0
HB1 A:ALA168 4.1 39.7 1.0
HB A:ILE236 4.2 51.6 1.0
HG21 A:ILE236 4.2 62.2 1.0
HD12 A:LEU197 4.2 84.7 1.0
CG A:PRO238 4.3 47.5 1.0
HG23 A:ILE236 4.4 62.2 1.0
HB2 A:ALA102 4.4 52.1 1.0
HB2 A:ALA168 4.4 39.7 1.0
CB A:ILE236 4.5 42.8 1.0
O A:ALA237 4.5 42.9 1.0
HD11 A:ILE149 4.5 57.5 1.0
HA A:PRO238 4.6 48.9 1.0
H A:ALA237 4.6 52.6 1.0
CE1 A:PHE221 4.6 31.8 1.0
HG2 A:PRO129 4.6 42.1 1.0
HD13 A:ILE149 4.7 57.5 1.0
C06 A:HLK400 4.7 58.7 1.0
CA A:ILE236 4.7 43.3 1.0
HD2 A:PRO238 4.7 52.0 1.0
CB A:ALA168 4.7 32.9 1.0
CD2 A:PHE221 4.8 36.5 1.0
HB1 A:ALA102 4.8 52.1 1.0
HE1 A:MET224 4.8 67.9 1.0
CA A:PRO238 4.8 40.5 1.0
C16 A:HLK400 4.9 58.3 1.0
HE1 A:PHE221 4.9 38.5 1.0
H011 A:HLK400 4.9 69.7 1.0
N01 A:HLK400 4.9 57.9 1.0
HG2 A:PRO238 5.0 57.3 1.0

Fluorine binding site 4 out of 8 in 6q7v

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Fluorine binding site 4 out of 8 in the Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 4 of Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F400

b:58.3
occ:1.00
F20 A:HLK400 0.0 58.3 1.0
C17 A:HLK400 1.4 53.8 1.0
F18 A:HLK400 2.2 58.8 1.0
F19 A:HLK400 2.2 59.6 1.0
C04 A:HLK400 2.4 41.1 1.0
HD11 A:ILE149 2.5 57.5 1.0
HD13 A:ILE149 2.5 57.5 1.0
HB2 A:ALA102 2.9 52.1 1.0
CD1 A:ILE149 2.9 47.7 1.0
HZ A:PHE221 3.1 37.0 1.0
N03 A:HLK400 3.1 44.2 1.0
HG2 A:PRO129 3.2 42.1 1.0
C05 A:HLK400 3.2 47.6 1.0
HB1 A:ALA102 3.2 52.1 1.0
H051 A:HLK400 3.2 57.4 1.0
HD12 A:ILE149 3.5 57.5 1.0
CB A:ALA102 3.5 43.2 1.0
HG3 A:PRO238 3.8 57.3 1.0
HB3 A:ALA102 3.9 52.1 1.0
CZ A:PHE221 4.0 30.7 1.0
CG A:PRO129 4.1 36.2 1.0
HG12 A:ILE149 4.1 53.9 1.0
CG1 A:ILE149 4.2 44.7 1.0
HG3 A:PRO129 4.3 42.1 1.0
C02 A:HLK400 4.3 50.7 1.0
C06 A:HLK400 4.4 58.7 1.0
HD3 A:PRO238 4.5 52.0 1.0
HG21 A:ILE149 4.5 40.0 1.0
HG22 A:ILE236 4.5 62.2 1.0
HB2 A:PRO129 4.5 49.7 1.0
HE2 A:PHE221 4.6 35.1 1.0
HB2 A:ALA168 4.6 39.7 1.0
HA A:ALA102 4.6 57.0 1.0
CG A:PRO238 4.7 47.5 1.0
HD12 A:LEU197 4.7 84.7 1.0
CA A:ALA102 4.7 47.3 1.0
CB A:PRO129 4.7 41.2 1.0
HG13 A:ILE149 4.7 53.9 1.0
HB3 A:PRO129 4.7 49.7 1.0
HE1 A:PHE221 4.8 38.5 1.0
CE2 A:PHE221 4.8 29.0 1.0
CE1 A:PHE221 4.9 31.8 1.0
C16 A:HLK400 4.9 58.3 1.0
HG21 A:THR265 4.9 55.5 1.0
HB1 A:ALA168 5.0 39.7 1.0
CD A:PRO238 5.0 43.1 1.0

Fluorine binding site 5 out of 8 in 6q7v

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Fluorine binding site 5 out of 8 in the Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 5 of Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F400

b:0.9
occ:1.00
F13 B:HLK400 0.0 0.9 1.0
C12 B:HLK400 1.4 0.9 1.0
C11 B:HLK400 2.4 0.4 1.0
C14 B:HLK400 2.4 1.0 1.0
H111 B:HLK400 2.5 0.8 1.0
H141 B:HLK400 2.6 0.6 1.0
HD13 B:ILE263 3.3 59.1 1.0
HD13 B:ILE186 3.3 0.9 1.0
HG21 B:VAL170 3.6 53.1 1.0
C10 B:HLK400 3.6 96.0 1.0
C15 B:HLK400 3.6 98.2 1.0
HD13 B:ILE236 3.7 57.4 1.0
HD11 B:ILE236 3.9 57.4 1.0
CD1 B:ILE263 4.0 49.0 1.0
HD12 B:ILE263 4.0 59.1 1.0
HG22 B:VAL170 4.0 53.1 1.0
HG23 B:VAL170 4.0 53.1 1.0
CG2 B:VAL170 4.1 44.0 1.0
C09 B:HLK400 4.1 92.2 1.0
HD11 B:ILE263 4.2 59.1 1.0
CD1 B:ILE186 4.2 0.7 1.0
CD1 B:ILE236 4.3 47.6 1.0
HD11 B:ILE186 4.3 0.9 1.0
H101 B:HLK400 4.4 0.5 1.0
H151 B:HLK400 4.4 0.1 1.0
HE1 B:TYR258 4.5 56.7 1.0
HG12 B:ILE236 4.5 57.7 1.0
HG21 B:ILE186 4.5 0.2 1.0
HG21 B:ILE263 4.6 54.0 1.0
CE1 B:TYR258 4.6 47.1 1.0
HD12 B:ILE186 4.7 0.9 1.0
CD1 B:TYR258 4.8 50.1 1.0
HD1 B:TYR258 4.9 60.4 1.0
HG12 B:ILE186 4.9 0.3 1.0
CG1 B:ILE236 5.0 47.9 1.0

Fluorine binding site 6 out of 8 in 6q7v

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Fluorine binding site 6 out of 8 in the Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 6 of Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F400

b:50.9
occ:1.00
F18 B:HLK400 0.0 50.9 1.0
C17 B:HLK400 1.4 48.8 1.0
F19 B:HLK400 2.2 49.8 1.0
F20 B:HLK400 2.2 57.5 1.0
C04 B:HLK400 2.4 41.0 1.0
HD11 B:ILE149 2.6 49.9 1.0
HD13 B:ILE149 2.6 49.9 1.0
HB2 B:ALA102 3.0 74.8 1.0
CD1 B:ILE149 3.0 41.4 1.0
HZ B:PHE221 3.0 44.5 1.0
N03 B:HLK400 3.2 44.9 1.0
C05 B:HLK400 3.2 45.5 1.0
H051 B:HLK400 3.2 54.8 1.0
HG2 B:PRO129 3.4 55.3 1.0
HB1 B:ALA102 3.4 74.8 1.0
HD12 B:ILE149 3.4 49.9 1.0
CB B:ALA102 3.6 62.1 1.0
CZ B:PHE221 3.9 36.9 1.0
HG3 B:PRO238 4.0 69.3 1.0
HB3 B:ALA102 4.1 74.8 1.0
CG B:PRO129 4.2 45.9 1.0
HG12 B:ILE149 4.2 40.2 1.0
CG1 B:ILE149 4.3 33.3 1.0
HE2 B:PHE221 4.3 40.5 1.0
C02 B:HLK400 4.3 49.0 1.0
HG3 B:PRO129 4.3 55.3 1.0
C06 B:HLK400 4.4 57.3 1.0
HD3 B:PRO238 4.4 66.9 1.0
CE2 B:PHE221 4.5 33.5 1.0
HG22 B:ILE236 4.5 64.2 1.0
HB2 B:PRO129 4.6 50.4 1.0
HB3 B:PRO129 4.6 50.4 1.0
HG21 B:ILE149 4.6 47.1 1.0
HA B:ALA102 4.7 76.1 1.0
CB B:PRO129 4.7 43.1 1.0
HB2 B:ALA168 4.7 47.5 1.0
HE1 B:PHE221 4.8 52.0 1.0
CA B:ALA102 4.8 63.2 1.0
HG13 B:ILE149 4.8 40.2 1.0
CE1 B:PHE221 4.8 43.1 1.0
CG B:PRO238 4.9 57.5 1.0
C16 B:HLK400 4.9 55.9 1.0
HD12 B:LEU197 4.9 64.3 1.0

Fluorine binding site 7 out of 8 in 6q7v

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Fluorine binding site 7 out of 8 in the Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 7 of Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F400

b:49.8
occ:1.00
F19 B:HLK400 0.0 49.8 1.0
C17 B:HLK400 1.4 48.8 1.0
F18 B:HLK400 2.2 50.9 1.0
F20 B:HLK400 2.2 57.5 1.0
C04 B:HLK400 2.3 41.0 1.0
H051 B:HLK400 2.4 54.8 1.0
HB2 B:ALA168 2.6 47.5 1.0
C05 B:HLK400 2.7 45.5 1.0
HB1 B:ALA168 2.9 47.5 1.0
CB B:ALA168 3.2 39.4 1.0
HG22 B:ILE236 3.3 64.2 1.0
N03 B:HLK400 3.5 44.9 1.0
HG3 B:PRO238 3.7 69.3 1.0
HA B:PRO238 3.7 61.0 1.0
HB3 B:ALA168 3.7 47.5 1.0
HD13 B:ILE149 3.8 49.9 1.0
N B:PRO238 3.9 48.1 1.0
C B:ALA237 3.9 50.4 1.0
HD3 B:PRO238 4.0 66.9 1.0
C06 B:HLK400 4.0 57.3 1.0
HB1 B:ALA102 4.0 74.8 1.0
O B:ALA237 4.1 53.1 1.0
CG2 B:ILE236 4.1 53.3 1.0
HA B:ALA237 4.2 59.2 1.0
HZ B:PHE221 4.2 44.5 1.0
CA B:PRO238 4.2 50.7 1.0
CD B:PRO238 4.3 55.6 1.0
HA B:ALA168 4.3 51.8 1.0
HG21 B:ILE236 4.3 64.2 1.0
HB2 B:ALA102 4.3 74.8 1.0
CG B:PRO238 4.3 57.5 1.0
HG1 B:THR265 4.4 61.8 1.0
CA B:ALA168 4.4 42.9 1.0
HD11 B:ILE149 4.5 49.9 1.0
CA B:ALA237 4.5 49.1 1.0
CD1 B:ILE149 4.5 41.4 1.0
HG23 B:ILE236 4.5 64.2 1.0
O B:ILE236 4.6 60.7 1.0
C02 B:HLK400 4.6 49.0 1.0
N B:ALA237 4.6 46.2 1.0
CB B:ALA102 4.7 62.1 1.0
HB3 B:PRO238 4.7 65.5 1.0
HE2 B:PHE221 4.7 40.5 1.0
C B:ILE236 4.7 49.8 1.0
CB B:PRO238 4.7 54.3 1.0
HD12 B:ILE149 4.7 49.9 1.0
H071 B:HLK400 4.8 84.8 1.0
CZ B:PHE221 4.8 36.9 1.0
C16 B:HLK400 4.9 55.9 1.0
N07 B:HLK400 4.9 70.4 1.0

Fluorine binding site 8 out of 8 in 6q7v

Go back to Fluorine Binding Sites List in 6q7v
Fluorine binding site 8 out of 8 in the Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 8 of Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F400

b:57.5
occ:1.00
F20 B:HLK400 0.0 57.5 1.0
C17 B:HLK400 1.4 48.8 1.0
F19 B:HLK400 2.2 49.8 1.0
F18 B:HLK400 2.2 50.9 1.0
C04 B:HLK400 2.4 41.0 1.0
N03 B:HLK400 2.7 44.9 1.0
HE2 B:PHE221 2.8 40.5 1.0
O B:ILE236 2.9 60.7 1.0
HZ B:PHE221 2.9 44.5 1.0
HG22 B:ILE236 3.0 64.2 1.0
HA B:ALA237 3.2 59.2 1.0
HD3 B:PRO238 3.4 66.9 1.0
CE2 B:PHE221 3.4 33.5 1.0
CZ B:PHE221 3.5 36.9 1.0
C B:ILE236 3.5 49.8 1.0
C05 B:HLK400 3.6 45.5 1.0
CA B:ALA237 3.8 49.1 1.0
H051 B:HLK400 3.8 54.8 1.0
CG2 B:ILE236 3.9 53.3 1.0
HB B:ILE236 3.9 56.3 1.0
N B:ALA237 3.9 46.2 1.0
C02 B:HLK400 4.0 49.0 1.0
C B:ALA237 4.1 50.4 1.0
HG3 B:PRO238 4.1 69.3 1.0
CD B:PRO238 4.2 55.6 1.0
HG21 B:ILE236 4.2 64.2 1.0
HB1 B:ALA168 4.2 47.5 1.0
N B:PRO238 4.2 48.1 1.0
CB B:ILE236 4.3 46.7 1.0
HD12 B:LEU197 4.5 64.3 1.0
HG23 B:ILE236 4.5 64.2 1.0
CA B:ILE236 4.5 47.8 1.0
HE1 B:MET224 4.5 74.9 1.0
H B:ALA237 4.6 55.7 1.0
HB2 B:ALA168 4.6 47.5 1.0
HD11 B:ILE149 4.6 49.9 1.0
HG2 B:PRO129 4.6 55.3 1.0
HB2 B:ALA102 4.6 74.8 1.0
CD2 B:PHE221 4.7 40.7 1.0
CG B:PRO238 4.7 57.5 1.0
O B:ALA237 4.7 53.1 1.0
C06 B:HLK400 4.7 57.3 1.0
HD13 B:ILE149 4.7 49.9 1.0
CE1 B:PHE221 4.8 43.1 1.0
H011 B:HLK400 4.8 58.7 1.0
C16 B:HLK400 4.9 55.9 1.0
CB B:ALA168 4.9 39.4 1.0
N01 B:HLK400 4.9 48.7 1.0
HD2 B:PRO238 4.9 66.9 1.0
HA B:PRO238 5.0 61.0 1.0
HD11 B:LEU197 5.0 64.3 1.0
HD2 B:PHE221 5.0 49.0 1.0

Reference:

M.Zender, F.Witzgall, A.F.Kiefer, B.Kirsch, C.K.Maurer, A.M.Kany, N.Xu, S.Schmelz, C.Borger, W.Blankenfeldt, M.Empting. Flexible Fragment Growing Boosts Potency of Quorum Sensing Inhibitors Against Pseudomonas Aeruginosa Virulence. Chemmedchem 2019.
ISSN: ESSN 1860-7187
PubMed: 31709767
DOI: 10.1002/CMDC.201900621
Page generated: Fri Aug 2 00:43:40 2024

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