Atomistry » Fluorine » PDB 3sb0-3sym » 3svq
Atomistry »
  Fluorine »
    PDB 3sb0-3sym »
      3svq »

Fluorine in PDB 3svq: Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine

Enzymatic activity of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine

All present enzymatic activity of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine:
1.14.13.39;

Protein crystallography data

The structure of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine, PDB code: 3svq was solved by H.Li, T.L.Poulos, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 43.82 / 2.18
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 51.751, 111.134, 164.708, 90.00, 90.00, 90.00
R / Rfree (%) 20.9 / 26.2

Other elements in 3svq:

The structure of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine also contains other interesting chemical elements:

Iron (Fe) 2 atoms
Zinc (Zn) 1 atom

Fluorine Binding Sites:

The binding sites of Fluorine atom in the Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine (pdb code 3svq). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 8 binding sites of Fluorine where determined in the Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine, PDB code: 3svq:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;

Fluorine binding site 1 out of 8 in 3svq

Go back to Fluorine Binding Sites List in 3svq
Fluorine binding site 1 out of 8 in the Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F800

b:86.3
occ:1.00
 F15 A:JK4800 0.0 86.3 1.0
C14 A:JK4800 1.3 83.1 1.0
F16 A:JK4800 2.1 84.8 1.0
C21 A:JK4800 2.3 79.9 1.0
C13 A:JK4800 2.3 83.6 1.0
OE1 A:GLU592 2.5 45.0 1.0
N12 A:JK4800 2.6 85.8 1.0
CBA A:HEM750 2.7 55.1 1.0
C26 A:JK4800 2.8 75.1 1.0
CGA A:HEM750 3.4 58.3 1.0
O2A A:HEM750 3.5 59.6 1.0
C22 A:JK4800 3.5 77.7 1.0
CD A:GLU592 3.6 45.9 1.0
C2A A:HEM750 3.6 45.4 1.0
O A:HOH82 3.7 44.2 1.0
C11 A:JK4800 3.8 88.3 1.0
C1A A:HEM750 3.8 45.6 1.0
CAA A:HEM750 3.8 51.3 1.0
C3A A:HEM750 3.9 46.2 1.0
F22 A:JK4800 4.0 77.3 1.0
C25 A:JK4800 4.1 73.4 1.0
OE2 A:GLU592 4.2 42.1 1.0
CHA A:HEM750 4.3 46.9 1.0
C4A A:HEM750 4.3 45.9 1.0
NA A:HEM750 4.3 45.8 1.0
O1A A:HEM750 4.4 57.6 1.0
CMA A:HEM750 4.5 47.5 1.0
C23 A:JK4800 4.6 76.7 1.0
CG A:GLU592 4.6 42.4 1.0
C10 A:JK4800 4.7 90.5 1.0
O09 A:JK4800 4.8 92.9 1.0
C24 A:JK4800 4.9 76.3 1.0

Fluorine binding site 2 out of 8 in 3svq

Go back to Fluorine Binding Sites List in 3svq
Fluorine binding site 2 out of 8 in the Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F800

b:84.8
occ:1.00
 F16 A:JK4800 0.0 84.8 1.0
C14 A:JK4800 1.3 83.1 1.0
F15 A:JK4800 2.1 86.3 1.0
C13 A:JK4800 2.3 83.6 1.0
C21 A:JK4800 2.4 79.9 1.0
F22 A:JK4800 2.6 77.3 1.0
C22 A:JK4800 2.8 77.7 1.0
N12 A:JK4800 2.8 85.8 1.0
CG2 A:VAL567 3.3 36.5 1.0
C11 A:JK4800 3.3 88.3 1.0
C26 A:JK4800 3.6 75.1 1.0
CBA A:HEM750 3.8 55.1 1.0
CHA A:HEM750 4.0 46.9 1.0
C23 A:JK4800 4.1 76.7 1.0
C1A A:HEM750 4.1 45.6 1.0
C4D A:HEM750 4.3 48.3 1.0
OE1 A:GLU592 4.4 45.0 1.0
O2A A:HEM750 4.4 59.6 1.0
NA A:HEM750 4.6 45.8 1.0
C2A A:HEM750 4.6 45.4 1.0
C10 A:JK4800 4.6 90.5 1.0
CGA A:HEM750 4.7 58.3 1.0
ND A:HEM750 4.7 43.9 1.0
CBD A:HEM750 4.7 55.7 1.0
CB A:VAL567 4.7 43.6 1.0
C25 A:JK4800 4.8 73.4 1.0
O09 A:JK4800 4.8 92.9 1.0
F23 A:JK4800 4.8 79.9 1.0
C3D A:HEM750 4.8 47.5 1.0
C24 A:JK4800 4.9 76.3 1.0
CAA A:HEM750 4.9 51.3 1.0
FE A:HEM750 5.0 43.7 1.0
O A:HOH82 5.0 44.2 1.0

Fluorine binding site 3 out of 8 in 3svq

Go back to Fluorine Binding Sites List in 3svq
Fluorine binding site 3 out of 8 in the Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 3 of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F800

b:77.3
occ:1.00
 F22 A:JK4800 0.0 77.3 1.0
C22 A:JK4800 1.3 77.7 1.0
C23 A:JK4800 2.2 76.7 1.0
C21 A:JK4800 2.4 79.9 1.0
F23 A:JK4800 2.4 79.9 1.0
F16 A:JK4800 2.6 84.8 1.0
C14 A:JK4800 2.9 83.1 1.0
CG2 A:VAL567 3.0 36.5 1.0
C13 A:JK4800 3.5 83.6 1.0
C24 A:JK4800 3.5 76.3 1.0
C26 A:JK4800 3.6 75.1 1.0
CE1 A:PHE584 3.9 43.6 1.0
F15 A:JK4800 4.0 86.3 1.0
CB A:VAL567 4.1 43.6 1.0
C25 A:JK4800 4.1 73.4 1.0
FE A:HEM750 4.5 43.7 1.0
CD1 A:PHE584 4.5 40.5 1.0
N A:VAL567 4.5 43.0 1.0
O A:PRO565 4.5 42.2 1.0
NC A:HEM750 4.5 41.1 1.0
ND A:HEM750 4.7 43.9 1.0
N12 A:JK4800 4.7 85.8 1.0
CB A:PRO565 4.8 40.6 1.0
C A:PRO565 4.8 41.5 1.0
C1C A:HEM750 4.8 42.6 1.0
CA A:VAL567 4.9 43.5 1.0
CZ A:PHE584 4.9 37.0 1.0
NB A:HEM750 4.9 42.8 1.0
N A:ALA566 4.9 42.9 1.0
C4C A:HEM750 5.0 40.7 1.0
O A:PHE584 5.0 40.1 1.0
C4D A:HEM750 5.0 48.3 1.0
C1D A:HEM750 5.0 46.1 1.0

Fluorine binding site 4 out of 8 in 3svq

Go back to Fluorine Binding Sites List in 3svq
Fluorine binding site 4 out of 8 in the Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 4 of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F800

b:79.9
occ:1.00
 F23 A:JK4800 0.0 79.9 1.0
C23 A:JK4800 1.4 76.7 1.0
C22 A:JK4800 2.3 77.7 1.0
F22 A:JK4800 2.4 77.3 1.0
C24 A:JK4800 2.5 76.3 1.0
N A:GLY586 3.1 42.0 1.0
CHC A:HEM750 3.3 43.6 1.0
C1C A:HEM750 3.3 42.6 1.0
C21 A:JK4800 3.6 79.9 1.0
C A:SER585 3.7 40.5 1.0
C25 A:JK4800 3.7 73.4 1.0
O A:PRO565 3.7 42.2 1.0
C4B A:HEM750 3.8 43.3 1.0
NC A:HEM750 3.8 41.1 1.0
CA A:GLY586 3.8 42.1 1.0
CA A:SER585 3.9 39.8 1.0
C2C A:HEM750 4.0 43.4 1.0
NB A:HEM750 4.1 42.8 1.0
C26 A:JK4800 4.1 75.1 1.0
CD1 A:PHE584 4.3 40.5 1.0
FE A:HEM750 4.4 43.7 1.0
CE1 A:PHE584 4.4 43.6 1.0
O A:SER585 4.5 40.1 1.0
C4C A:HEM750 4.5 40.7 1.0
CMC A:HEM750 4.5 39.2 1.0
N A:SER585 4.5 38.5 1.0
C3C A:HEM750 4.6 40.0 1.0
C A:PRO565 4.6 41.5 1.0
CG A:PRO565 4.6 39.8 1.0
C A:GLY586 4.6 43.6 1.0
C3B A:HEM750 4.6 43.3 1.0
O A:PHE584 4.7 40.1 1.0
CB A:PRO565 4.7 40.6 1.0
C14 A:JK4800 4.7 83.1 1.0
N A:TRP587 4.7 42.8 1.0
F16 A:JK4800 4.8 84.8 1.0
C A:PHE584 4.9 39.1 1.0
C1B A:HEM750 4.9 44.6 1.0

Fluorine binding site 5 out of 8 in 3svq

Go back to Fluorine Binding Sites List in 3svq
Fluorine binding site 5 out of 8 in the Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 5 of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F800

b:78.8
occ:1.00
 F15 B:JK4800 0.0 78.8 1.0
C14 B:JK4800 1.3 73.2 1.0
F16 B:JK4800 2.1 73.2 1.0
C21 B:JK4800 2.3 68.3 1.0
C13 B:JK4800 2.3 71.4 1.0
CBA B:HEM750 2.5 52.2 1.0
OE1 B:GLU592 2.7 46.0 1.0
C26 B:JK4800 2.7 64.7 1.0
N12 B:JK4800 2.8 72.3 1.0
O2A B:HEM750 3.0 59.3 1.0
CGA B:HEM750 3.2 55.3 1.0
C2A B:HEM750 3.3 44.6 1.0
O B:HOH19 3.4 48.9 1.0
CAA B:HEM750 3.5 51.1 1.0
C22 B:JK4800 3.6 67.8 1.0
C1A B:HEM750 3.7 47.0 1.0
C3A B:HEM750 3.7 45.1 1.0
CD B:GLU592 3.8 46.3 1.0
C25 B:JK4800 4.1 61.6 1.0
CHA B:HEM750 4.2 45.2 1.0
F22 B:JK4800 4.2 72.6 1.0
C11 B:JK4800 4.2 73.4 1.0
C4A B:HEM750 4.3 45.1 1.0
CMA B:HEM750 4.3 43.8 1.0
NA B:HEM750 4.3 45.5 1.0
O1A B:HEM750 4.4 57.3 1.0
OE2 B:GLU592 4.4 40.9 1.0
C23 B:JK4800 4.7 64.8 1.0
CG B:GLU592 4.7 43.0 1.0
C24 B:JK4800 4.9 64.5 1.0
C4D B:HEM750 4.9 46.2 1.0

Fluorine binding site 6 out of 8 in 3svq

Go back to Fluorine Binding Sites List in 3svq
Fluorine binding site 6 out of 8 in the Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 6 of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F800

b:73.2
occ:1.00
 F16 B:JK4800 0.0 73.2 1.0
C14 B:JK4800 1.3 73.2 1.0
F15 B:JK4800 2.1 78.8 1.0
C13 B:JK4800 2.4 71.4 1.0
C21 B:JK4800 2.4 68.3 1.0
F22 B:JK4800 2.8 72.6 1.0
N12 B:JK4800 2.8 72.3 1.0
C22 B:JK4800 2.9 67.8 1.0
CG2 B:VAL567 3.5 38.3 1.0
C26 B:JK4800 3.6 64.7 1.0
CHA B:HEM750 3.8 45.2 1.0
C1A B:HEM750 3.9 47.0 1.0
O2A B:HEM750 3.9 59.3 1.0
C4D B:HEM750 4.0 46.2 1.0
CBA B:HEM750 4.0 52.2 1.0
C11 B:JK4800 4.0 73.4 1.0
C23 B:JK4800 4.2 64.8 1.0
C2A B:HEM750 4.3 44.6 1.0
ND B:HEM750 4.4 41.8 1.0
CBD B:HEM750 4.4 51.1 1.0
CGA B:HEM750 4.5 55.3 1.0
NA B:HEM750 4.5 45.5 1.0
C3D B:HEM750 4.5 46.3 1.0
CAA B:HEM750 4.5 51.1 1.0
OE1 B:GLU592 4.6 46.0 1.0
C25 B:JK4800 4.8 61.6 1.0
FE B:HEM750 4.9 43.0 1.0
F23 B:JK4800 4.9 64.1 1.0
CB B:VAL567 4.9 40.9 1.0
C3A B:HEM750 4.9 45.1 1.0
O B:HOH19 4.9 48.9 1.0
C24 B:JK4800 5.0 64.5 1.0

Fluorine binding site 7 out of 8 in 3svq

Go back to Fluorine Binding Sites List in 3svq
Fluorine binding site 7 out of 8 in the Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 7 of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F800

b:72.6
occ:1.00
 F22 B:JK4800 0.0 72.6 1.0
C22 B:JK4800 1.3 67.8 1.0
C23 B:JK4800 2.2 64.8 1.0
F23 B:JK4800 2.4 64.1 1.0
C21 B:JK4800 2.4 68.3 1.0
F16 B:JK4800 2.8 73.2 1.0
C14 B:JK4800 3.0 73.2 1.0
CG2 B:VAL567 3.3 38.3 1.0
C24 B:JK4800 3.5 64.5 1.0
C13 B:JK4800 3.6 71.4 1.0
C26 B:JK4800 3.6 64.7 1.0
CE1 B:PHE584 3.7 39.8 1.0
C25 B:JK4800 4.1 61.6 1.0
CB B:VAL567 4.2 40.9 1.0
F15 B:JK4800 4.2 78.8 1.0
CD1 B:PHE584 4.2 35.7 1.0
FE B:HEM750 4.5 43.0 1.0
NC B:HEM750 4.5 45.4 1.0
N B:VAL567 4.5 40.3 1.0
CZ B:PHE584 4.6 41.3 1.0
ND B:HEM750 4.6 41.8 1.0
O B:PRO565 4.7 38.1 1.0
N12 B:JK4800 4.7 72.3 1.0
C4C B:HEM750 4.8 43.4 1.0
C1C B:HEM750 4.9 44.0 1.0
C1D B:HEM750 4.9 42.8 1.0
C B:PRO565 5.0 39.8 1.0
C4D B:HEM750 5.0 46.2 1.0
CB B:PRO565 5.0 39.1 1.0

Fluorine binding site 8 out of 8 in 3svq

Go back to Fluorine Binding Sites List in 3svq
Fluorine binding site 8 out of 8 in the Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 8 of Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(2,3-Difluorophenyl)Ethyl) Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F800

b:64.1
occ:1.00
 F23 B:JK4800 0.0 64.1 1.0
C23 B:JK4800 1.3 64.8 1.0
C22 B:JK4800 2.2 67.8 1.0
F22 B:JK4800 2.4 72.6 1.0
C24 B:JK4800 2.4 64.5 1.0
N B:GLY586 3.2 38.5 1.0
C21 B:JK4800 3.5 68.3 1.0
C1C B:HEM750 3.6 44.0 1.0
CHC B:HEM750 3.6 43.9 1.0
C25 B:JK4800 3.7 61.6 1.0
C B:SER585 3.7 37.9 1.0
O B:PRO565 3.8 38.1 1.0
C4B B:HEM750 3.8 45.3 1.0
CA B:SER585 3.9 37.5 1.0
CA B:GLY586 3.9 39.6 1.0
NC B:HEM750 4.0 45.4 1.0
C26 B:JK4800 4.0 64.7 1.0
C2C B:HEM750 4.1 45.2 1.0
NB B:HEM750 4.3 44.0 1.0
CD1 B:PHE584 4.3 35.7 1.0
CE1 B:PHE584 4.4 39.8 1.0
C3B B:HEM750 4.4 45.0 1.0
FE B:HEM750 4.5 43.0 1.0
C4C B:HEM750 4.5 43.4 1.0
CG B:PRO565 4.6 40.4 1.0
O B:SER585 4.6 37.2 1.0
N B:SER585 4.6 36.3 1.0
CMC B:HEM750 4.6 47.9 1.0
C3C B:HEM750 4.6 42.9 1.0
C B:PRO565 4.6 39.8 1.0
C B:GLY586 4.7 40.7 1.0
CB B:PRO565 4.7 39.1 1.0
O B:PHE584 4.8 34.0 1.0
C14 B:JK4800 4.8 73.2 1.0
N B:TRP587 4.8 40.3 1.0
F16 B:JK4800 4.9 73.2 1.0
CAB B:HEM750 4.9 47.9 1.0
C B:PHE584 5.0 36.9 1.0
C1B B:HEM750 5.0 44.0 1.0

Reference:

F.Xue, J.M.Kraus, K.J.Labby, H.Ji, J.Mataka, G.Xia, H.Li, S.L.Delker, L.J.Roman, P.Martasek, T.L.Poulos, R.B.Silverman. Improved Synthesis of Chiral Pyrrolidine Inhibitors and Their Binding Properties to Neuronal Nitric Oxide Synthase. J.Med.Chem. V. 54 6399 2011.
ISSN: ISSN 0022-2623
PubMed: 21809851
DOI: 10.1021/JM200411J
Page generated: Mon Jul 14 19:23:52 2025

Last articles

Fe in 2YXO
Fe in 2YRS
Fe in 2YXC
Fe in 2YNM
Fe in 2YVJ
Fe in 2YP1
Fe in 2YU2
Fe in 2YU1
Fe in 2YQB
Fe in 2YOO
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy