Atomistry » Fluorine » PDB 6q0t-6qhv » 6q2t
Atomistry »
  Fluorine »
    PDB 6q0t-6qhv »
      6q2t »

Fluorine in PDB 6q2t: Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide

Enzymatic activity of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide

All present enzymatic activity of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide:
1.14.13.70; 1.14.14.154;

Protein crystallography data

The structure of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide, PDB code: 6q2t was solved by L.Friggeri, T.Y.Hargrove, Z.Wawrzak, G.I.Lepesheva, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 28.10 / 2.80
Space group I 4
Cell size a, b, c (Å), α, β, γ (°) 117.664, 117.664, 157.842, 90.00, 90.00, 90.00
R / Rfree (%) 22.7 / 25.6

Other elements in 6q2t:

The structure of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide also contains other interesting chemical elements:

Iron (Fe) 2 atoms
Chlorine (Cl) 3 atoms

Fluorine Binding Sites:

The binding sites of Fluorine atom in the Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide (pdb code 6q2t). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 9 binding sites of Fluorine where determined in the Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide, PDB code: 6q2t:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9;

Fluorine binding site 1 out of 9 in 6q2t

Go back to Fluorine Binding Sites List in 6q2t
Fluorine binding site 1 out of 9 in the Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F602

b:0.8
occ:1.00
 F5 A:PJM602 0.0 0.8 1.0
C5 A:PJM602 1.4 0.5 1.0
C6 A:PJM602 2.4 0.2 1.0
C4 A:PJM602 2.4 0.6 1.0
CAV A:PJM602 2.6 0.4 1.0
CBQ A:PJM602 2.8 0.1 1.0
N3 A:PJM602 3.6 0.8 1.0
N1 A:PJM602 3.6 0.7 1.0
CZ2 A:TRP239 3.8 0.3 1.0
CBI A:PJM602 3.9 0.1 1.0
CZ A:PHE105 3.9 98.7 1.0
CH2 A:TRP239 4.0 91.1 1.0
CE2 A:PHE105 4.0 95.8 1.0
C2 A:PJM602 4.1 0.2 1.0
CAX A:PJM602 4.2 0.5 1.0
CE2 A:TRP239 4.3 0.2 1.0
FAC A:PJM602 4.4 92.3 1.0
CE A:MET381 4.7 0.6 1.0
CZ3 A:TRP239 4.7 96.4 1.0
CE1 A:PHE105 4.9 88.8 1.0
NE1 A:TRP239 4.9 0.6 1.0
SD A:MET100 4.9 70.0 1.0
CAU A:PJM602 4.9 0.9 1.0
C22 A:DXC609 5.0 0.9 1.0
CD2 A:TRP239 5.0 92.5 1.0

Fluorine binding site 2 out of 9 in 6q2t

Go back to Fluorine Binding Sites List in 6q2t
Fluorine binding site 2 out of 9 in the Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F602

b:92.3
occ:1.00
 FAC A:PJM602 0.0 92.3 1.0
CBI A:PJM602 1.4 0.1 1.0
CAV A:PJM602 2.4 0.4 1.0
CAU A:PJM602 2.4 0.9 1.0
CE3 A:TRP239 3.6 97.7 1.0
CBP A:PJM602 3.6 0.1 1.0
CBQ A:PJM602 3.7 0.1 1.0
CD2 A:TRP239 3.8 92.5 1.0
OE1 A:GLN400 4.0 0.2 1.0
CG A:TRP239 4.1 85.5 1.0
CAX A:PJM602 4.1 0.5 1.0
CB A:TRP239 4.2 88.3 1.0
CZ3 A:TRP239 4.2 96.4 1.0
F5 A:PJM602 4.4 0.8 1.0
CE2 A:TRP239 4.5 0.2 1.0
O A:TRP239 4.7 75.2 1.0
CBT A:PJM602 4.7 0.4 1.0
CD1 A:TRP239 4.8 0.9 1.0
C4 A:PJM602 4.8 0.6 1.0
CH2 A:TRP239 4.9 91.1 1.0
CD A:GLN400 4.9 0.9 1.0
CZ2 A:TRP239 5.0 0.3 1.0

Fluorine binding site 3 out of 9 in 6q2t

Go back to Fluorine Binding Sites List in 6q2t
Fluorine binding site 3 out of 9 in the Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 3 of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F602

b:0.7
occ:1.00
 FAB A:PJM602 0.0 0.7 1.0
CBH A:PJM602 1.4 0.3 1.0
CAI A:PJM602 2.4 0.3 1.0
CAH A:PJM602 2.4 0.7 1.0
CD1 A:LEU159 3.1 0.3 1.0
CA A:MET304 3.6 84.2 1.0
CAM A:PJM602 3.6 0.4 1.0
CAL A:PJM602 3.6 0.9 1.0
CG A:MET304 3.7 97.8 1.0
O A:MET304 3.7 84.5 1.0
CB A:MET304 3.7 84.5 1.0
CD2 A:LEU159 4.1 0.7 1.0
CBM A:PJM602 4.1 96.9 1.0
CG A:LEU159 4.1 0.7 1.0
C A:MET304 4.2 87.8 1.0
CG1 A:VAL143 4.5 99.6 1.0
N A:LEU308 4.6 93.8 1.0
CA A:GLY307 4.6 77.5 1.0
CE A:MET304 4.8 0.4 1.0
N A:MET304 4.8 87.2 1.0
C A:GLY307 4.9 86.1 1.0
CG A:LEU308 5.0 0.9 1.0

Fluorine binding site 4 out of 9 in 6q2t

Go back to Fluorine Binding Sites List in 6q2t
Fluorine binding site 4 out of 9 in the Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 4 of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F611

b:73.7
occ:1.00
 F5 A:PJM611 0.0 73.7 1.0
C5 A:PJM611 1.4 90.1 1.0
C6 A:PJM611 2.4 0.0 1.0
C4 A:PJM611 2.4 95.8 1.0
CAV A:PJM611 2.5 0.6 1.0
CBQ A:PJM611 2.8 0.5 1.0
N3 A:PJM611 3.6 99.2 1.0
N1 A:PJM611 3.6 0.4 1.0
CBI A:PJM611 3.8 0.4 1.0
C2 A:PJM611 4.1 0.9 1.0
CAX A:PJM611 4.2 93.5 1.0
FAC A:PJM611 4.3 0.4 1.0
CAU A:PJM611 4.9 97.8 1.0

Fluorine binding site 5 out of 9 in 6q2t

Go back to Fluorine Binding Sites List in 6q2t
Fluorine binding site 5 out of 9 in the Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 5 of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F611

b:0.4
occ:1.00
 FAC A:PJM611 0.0 0.4 1.0
CBI A:PJM611 1.4 0.4 1.0
CAU A:PJM611 2.4 97.8 1.0
CAV A:PJM611 2.4 0.6 1.0
CBP A:PJM611 3.6 89.8 1.0
CBQ A:PJM611 3.7 0.5 1.0
O A:HOH702 3.8 38.6 1.0
CAX A:PJM611 4.2 93.5 1.0
F5 A:PJM611 4.3 73.7 1.0
O1 A:DXC605 4.4 56.6 1.0
C24 A:DXC605 4.5 42.7 1.0
CBT A:PJM611 4.7 99.6 1.0
C4 A:PJM611 4.8 95.8 1.0
C6 A:DXC603 4.9 52.4 1.0

Fluorine binding site 6 out of 9 in 6q2t

Go back to Fluorine Binding Sites List in 6q2t
Fluorine binding site 6 out of 9 in the Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 6 of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F611

b:0.1
occ:1.00
 FAB A:PJM611 0.0 0.1 1.0
CBH A:PJM611 1.4 0.2 1.0
CAI A:PJM611 2.4 0.8 1.0
CAH A:PJM611 2.4 0.5 1.0
CAM A:PJM611 3.7 0.1 1.0
CAL A:PJM611 3.7 0.4 1.0
CBM A:PJM611 4.2 0.2 1.0

Fluorine binding site 7 out of 9 in 6q2t

Go back to Fluorine Binding Sites List in 6q2t
Fluorine binding site 7 out of 9 in the Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 7 of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F602

b:0.2
occ:1.00
 F5 B:PJM602 0.0 0.2 1.0
C5 B:PJM602 1.4 0.3 1.0
C6 B:PJM602 2.4 0.1 1.0
C4 B:PJM602 2.4 0.7 1.0
CAV B:PJM602 2.6 0.7 1.0
CBQ B:PJM602 2.8 0.3 1.0
CZ2 B:TRP239 3.4 0.3 1.0
CH2 B:TRP239 3.6 0.3 1.0
N3 B:PJM602 3.6 1.0 1.0
N1 B:PJM602 3.7 0.6 1.0
CBI B:PJM602 3.8 0.8 1.0
CZ B:PHE105 3.9 88.1 1.0
CE2 B:TRP239 3.9 0.4 1.0
CE2 B:PHE105 4.1 77.2 1.0
C2 B:PJM602 4.1 0.5 1.0
CAX B:PJM602 4.2 0.5 1.0
CZ3 B:TRP239 4.3 0.5 1.0
FAC B:PJM602 4.4 86.5 1.0
NE1 B:TRP239 4.5 0.8 1.0
CD2 B:TRP239 4.5 0.6 1.0
CE3 B:TRP239 4.7 0.1 1.0
CE B:MET381 4.7 0.1 1.0
CE1 B:PHE105 4.8 79.6 1.0
SD B:MET381 4.8 0.7 1.0
CAU B:PJM602 4.9 0.1 1.0

Fluorine binding site 8 out of 9 in 6q2t

Go back to Fluorine Binding Sites List in 6q2t
Fluorine binding site 8 out of 9 in the Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 8 of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F602

b:86.5
occ:1.00
 FAC B:PJM602 0.0 86.5 1.0
CBI B:PJM602 1.4 0.8 1.0
CAV B:PJM602 2.4 0.7 1.0
CAU B:PJM602 2.4 0.1 1.0
CE3 B:TRP239 3.2 0.1 1.0
O B:HOH716 3.3 77.8 1.0
CD2 B:TRP239 3.6 0.6 1.0
CBQ B:PJM602 3.7 0.3 1.0
CBP B:PJM602 3.7 0.3 1.0
CZ3 B:TRP239 3.7 0.5 1.0
OE1 B:GLN400 3.8 96.7 1.0
CG B:TRP239 4.1 83.0 1.0
CAX B:PJM602 4.1 0.5 1.0
CB B:TRP239 4.3 81.5 1.0
F5 B:PJM602 4.4 0.2 1.0
CE2 B:TRP239 4.5 0.4 1.0
CH2 B:TRP239 4.6 0.3 1.0
CE B:MET381 4.7 0.1 1.0
CBT B:PJM602 4.8 0.0 1.0
C4 B:PJM602 4.8 0.7 1.0
CZ2 B:TRP239 4.9 0.3 1.0
CD B:GLN400 4.9 88.3 1.0
NH2 B:ARG133 5.0 0.1 1.0
O B:VAL130 5.0 82.5 1.0

Fluorine binding site 9 out of 9 in 6q2t

Go back to Fluorine Binding Sites List in 6q2t
Fluorine binding site 9 out of 9 in the Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 9 of Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F602

b:86.4
occ:1.00
 FAB B:PJM602 0.0 86.4 1.0
CBH B:PJM602 1.4 87.2 1.0
CAI B:PJM602 2.4 82.3 1.0
CAH B:PJM602 2.4 98.0 1.0
CA B:MET304 3.4 70.2 1.0
O B:MET304 3.6 62.0 1.0
CD1 B:LEU159 3.6 97.4 1.0
CAM B:PJM602 3.6 85.7 1.0
CAL B:PJM602 3.6 96.8 1.0
CG B:MET304 3.7 77.7 1.0
CB B:MET304 3.8 69.3 1.0
C B:MET304 4.0 67.2 1.0
CG1 B:VAL143 4.1 86.5 1.0
CBM B:PJM602 4.1 89.2 1.0
CD2 B:LEU159 4.5 95.5 1.0
N B:MET304 4.6 75.0 1.0
CA B:GLY307 4.7 64.8 1.0
CG B:LEU159 4.7 0.1 1.0
N B:LEU308 4.7 67.1 1.0
O B:GLY303 4.8 90.5 1.0
C B:GLY307 4.9 67.9 1.0

Reference:

L.Friggeri, T.Y.Hargrove, Z.Wawrzak, F.P.Guengerich, G.I.Lepesheva. Validation of Human Sterol 14 Alpha-Demethylase (CYP51) Druggability: Structure-Guided Design, Synthesis and Evaluation of Stoichiometric, Functionally Irreversible Inhibitors. J.Med.Chem. 2019.
ISSN: ISSN 0022-2623
PubMed: 31663733
DOI: 10.1021/ACS.JMEDCHEM.9B01485
Page generated: Fri Aug 2 00:41:10 2024

Last articles

Zn in 9JYW
Zn in 9IR4
Zn in 9IR3
Zn in 9GMX
Zn in 9GMW
Zn in 9JEJ
Zn in 9ERF
Zn in 9ERE
Zn in 9EGV
Zn in 9EGW
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy