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Fluorine in PDB 6vkv: Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer

Protein crystallography data

The structure of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer, PDB code: 6vkv was solved by S.M.Bester, M.Kvaratskhelia, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 44.26 / 2.22
Space group P 6
Cell size a, b, c (Å), α, β, γ (°) 160.050, 160.050, 57.526, 90.00, 90.00, 120.00
R / Rfree (%) 23.1 / 26.9

Other elements in 6vkv:

The structure of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer also contains other interesting chemical elements:

Iodine (I) 5 atoms
Chlorine (Cl) 20 atoms

Fluorine Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 20; Page 3, Binding sites: 21 - 30; Page 4, Binding sites: 31 - 40; Page 5, Binding sites: 41 - 50; Page 6, Binding sites: 51 - 60;

Binding sites:

The binding sites of Fluorine atom in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer (pdb code 6vkv). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 60 binding sites of Fluorine where determined in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer, PDB code: 6vkv:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Fluorine binding site 1 out of 60 in 6vkv

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Fluorine binding site 1 out of 60 in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F301

b:26.8
occ:0.51
F26 A:QNG301 0.0 26.8 0.5
F26 A:QNG301 0.2 26.9 0.2
C24 A:QNG301 1.4 26.0 0.5
C24 A:QNG301 1.4 26.1 0.2
C25 A:QNG301 2.3 27.3 0.2
C25 A:QNG301 2.4 27.3 0.5
C23 A:QNG301 2.4 25.9 0.5
C23 A:QNG301 2.5 26.3 0.2
CG A:LYS70 3.2 40.9 1.0
CD1 A:ILE73 3.2 34.0 1.0
N A:LYS70 3.2 30.6 1.0
CB A:LEU69 3.4 35.4 1.0
C A:LEU69 3.5 33.7 1.0
CG A:LEU69 3.5 36.8 1.0
CA A:LYS70 3.6 32.6 1.0
C20 A:QNG301 3.6 28.4 0.2
C20 A:QNG301 3.7 28.6 0.5
C22 A:QNG301 3.7 27.8 0.5
O A:MET66 3.7 26.5 1.0
C22 A:QNG301 3.7 27.9 0.2
O A:LEU69 3.9 33.1 1.0
CB A:LYS70 3.9 36.9 1.0
CD2 A:LEU69 4.0 31.2 1.0
CA A:LEU69 4.1 33.2 1.0
C21 A:QNG301 4.2 28.4 0.5
C21 A:QNG301 4.2 28.6 0.2
CD A:LYS70 4.4 44.3 1.0
CG1 A:ILE73 4.4 28.7 1.0
CD1 A:LEU56 4.4 18.3 1.0
F42 A:QNG301 4.6 33.7 0.5
F42 A:QNG301 4.6 33.6 0.2
F27 A:QNG301 4.8 30.9 0.5
C A:MET66 4.8 29.0 1.0
CD1 A:LEU69 4.8 40.0 1.0
C19 A:QNG301 4.9 29.3 0.2
F27 A:QNG301 4.9 30.1 0.2
C19 A:QNG301 4.9 29.0 0.5
C A:LYS70 5.0 33.4 1.0
N A:LEU69 5.0 28.3 1.0

Fluorine binding site 2 out of 60 in 6vkv

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Fluorine binding site 2 out of 60 in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F301

b:26.9
occ:0.25
F26 A:QNG301 0.0 26.9 0.2
F26 A:QNG301 0.2 26.8 0.5
C24 A:QNG301 1.4 26.0 0.5
C24 A:QNG301 1.4 26.1 0.2
C23 A:QNG301 2.3 25.9 0.5
C25 A:QNG301 2.4 27.3 0.2
C23 A:QNG301 2.4 26.3 0.2
C25 A:QNG301 2.5 27.3 0.5
N A:LYS70 3.2 30.6 1.0
CG A:LYS70 3.2 40.9 1.0
CB A:LEU69 3.3 35.4 1.0
CD1 A:ILE73 3.4 34.0 1.0
CG A:LEU69 3.4 36.8 1.0
C A:LEU69 3.4 33.7 1.0
O A:MET66 3.6 26.5 1.0
CA A:LYS70 3.6 32.6 1.0
C22 A:QNG301 3.6 27.8 0.5
C20 A:QNG301 3.7 28.4 0.2
C22 A:QNG301 3.7 27.9 0.2
C20 A:QNG301 3.7 28.6 0.5
CD2 A:LEU69 3.8 31.2 1.0
O A:LEU69 3.9 33.1 1.0
CA A:LEU69 4.0 33.2 1.0
CB A:LYS70 4.0 36.9 1.0
C21 A:QNG301 4.1 28.4 0.5
C21 A:QNG301 4.2 28.6 0.2
CD A:LYS70 4.4 44.3 1.0
CD1 A:LEU56 4.5 18.3 1.0
CG1 A:ILE73 4.5 28.7 1.0
F42 A:QNG301 4.6 33.7 0.5
F42 A:QNG301 4.6 33.6 0.2
F27 A:QNG301 4.7 30.9 0.5
C A:MET66 4.7 29.0 1.0
CD1 A:LEU69 4.8 40.0 1.0
F27 A:QNG301 4.8 30.1 0.2
N A:LEU69 4.9 28.3 1.0
C19 A:QNG301 4.9 29.3 0.2

Fluorine binding site 3 out of 60 in 6vkv

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Fluorine binding site 3 out of 60 in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 3 of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F301

b:30.9
occ:0.51
F27 A:QNG301 0.0 30.9 0.5
F27 A:QNG301 0.1 30.1 0.2
C22 A:QNG301 1.3 27.9 0.2
C22 A:QNG301 1.4 27.8 0.5
C23 A:QNG301 2.3 26.3 0.2
C21 A:QNG301 2.3 28.6 0.2
C21 A:QNG301 2.4 28.4 0.5
C23 A:QNG301 2.4 25.9 0.5
F41 A:QNG301 2.6 36.0 0.5
F41 A:QNG301 2.6 35.5 0.2
CE A:MET66 3.1 42.0 1.0
CB A:MET66 3.2 30.3 1.0
O A:LEU56 3.2 26.5 1.0
CG A:MET66 3.3 36.3 1.0
F42 A:QNG301 3.4 33.6 0.2
F42 A:QNG301 3.4 33.7 0.5
C38 A:QNG301 3.5 33.8 0.5
C38 A:QNG301 3.5 33.7 0.2
C24 A:QNG301 3.6 26.1 0.2
C20 A:QNG301 3.6 28.4 0.2
C24 A:QNG301 3.7 26.0 0.5
C20 A:QNG301 3.7 28.6 0.5
C A:LEU56 3.8 25.3 1.0
SD A:MET66 3.9 39.9 1.0
C25 A:QNG301 4.1 27.3 0.2
CB A:LEU56 4.1 20.1 1.0
C25 A:QNG301 4.2 27.3 0.5
CA A:MET66 4.3 29.8 1.0
C37 A:QNG301 4.3 34.2 0.5
C37 A:QNG301 4.3 34.1 0.2
OD1 A:ASN57 4.5 37.7 1.0
N A:ASN57 4.5 23.6 1.0
CA A:LEU56 4.5 23.9 1.0
O A:MET66 4.6 26.5 1.0
CA A:ASN57 4.6 23.4 1.0
F26 A:QNG301 4.7 26.9 0.2
C32 A:QNG301 4.7 31.8 0.5
C A:MET66 4.7 29.0 1.0
C32 A:QNG301 4.8 31.9 0.2
F26 A:QNG301 4.8 26.8 0.5
C19 A:QNG301 4.9 29.3 0.2
OE1 A:GLN63 4.9 34.0 1.0
C19 A:QNG301 5.0 29.0 0.5

Fluorine binding site 4 out of 60 in 6vkv

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Fluorine binding site 4 out of 60 in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 4 of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F301

b:30.1
occ:0.25
F27 A:QNG301 0.0 30.1 0.2
F27 A:QNG301 0.1 30.9 0.5
C22 A:QNG301 1.4 27.9 0.2
C22 A:QNG301 1.5 27.8 0.5
C21 A:QNG301 2.4 28.6 0.2
C23 A:QNG301 2.4 26.3 0.2
C21 A:QNG301 2.4 28.4 0.5
F41 A:QNG301 2.5 36.0 0.5
C23 A:QNG301 2.5 25.9 0.5
F41 A:QNG301 2.5 35.5 0.2
CE A:MET66 3.1 42.0 1.0
O A:LEU56 3.2 26.5 1.0
CB A:MET66 3.2 30.3 1.0
CG A:MET66 3.3 36.3 1.0
F42 A:QNG301 3.4 33.6 0.2
F42 A:QNG301 3.4 33.7 0.5
C38 A:QNG301 3.5 33.8 0.5
C38 A:QNG301 3.5 33.7 0.2
C20 A:QNG301 3.7 28.4 0.2
C24 A:QNG301 3.7 26.1 0.2
C20 A:QNG301 3.7 28.6 0.5
C24 A:QNG301 3.8 26.0 0.5
C A:LEU56 3.8 25.3 1.0
SD A:MET66 3.9 39.9 1.0
CB A:LEU56 4.1 20.1 1.0
C25 A:QNG301 4.2 27.3 0.2
C25 A:QNG301 4.2 27.3 0.5
C37 A:QNG301 4.3 34.2 0.5
C37 A:QNG301 4.3 34.1 0.2
CA A:MET66 4.3 29.8 1.0
OD1 A:ASN57 4.4 37.7 1.0
N A:ASN57 4.5 23.6 1.0
CA A:LEU56 4.5 23.9 1.0
CA A:ASN57 4.6 23.4 1.0
O A:MET66 4.7 26.5 1.0
C32 A:QNG301 4.7 31.8 0.5
C32 A:QNG301 4.7 31.9 0.2
C A:MET66 4.8 29.0 1.0
F26 A:QNG301 4.8 26.9 0.2
OE1 A:GLN63 4.8 34.0 1.0
F26 A:QNG301 4.9 26.8 0.5
C19 A:QNG301 5.0 29.3 0.2
NE2 A:GLN63 5.0 29.9 1.0
C19 A:QNG301 5.0 29.0 0.5

Fluorine binding site 5 out of 60 in 6vkv

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Fluorine binding site 5 out of 60 in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 5 of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F301

b:36.0
occ:0.51
F41 A:QNG301 0.0 36.0 0.5
F41 A:QNG301 0.1 35.5 0.2
C38 A:QNG301 1.4 33.7 0.2
C38 A:QNG301 1.4 33.8 0.5
F42 A:QNG301 2.2 33.6 0.2
F42 A:QNG301 2.2 33.7 0.5
C37 A:QNG301 2.4 34.2 0.5
C37 A:QNG301 2.4 34.1 0.2
C32 A:QNG301 2.4 31.8 0.5
C32 A:QNG301 2.4 31.9 0.2
F27 A:QNG301 2.5 30.1 0.2
F27 A:QNG301 2.6 30.9 0.5
C22 A:QNG301 3.0 27.9 0.2
C22 A:QNG301 3.1 27.8 0.5
N33 A:QNG301 3.2 29.7 0.5
N33 A:QNG301 3.3 29.8 0.2
NE2 A:GLN63 3.4 29.9 1.0
C31 A:QNG301 3.4 33.2 0.5
C39 A:QNG301 3.4 33.7 0.5
C31 A:QNG301 3.4 32.9 0.2
C39 A:QNG301 3.5 33.8 0.2
C36 A:QNG301 3.5 33.9 0.5
C21 A:QNG301 3.5 28.6 0.2
C36 A:QNG301 3.5 33.8 0.2
C30 A:QNG301 3.6 29.2 0.2
C21 A:QNG301 3.6 28.4 0.5
C30 A:QNG301 3.6 29.1 0.5
CB A:MET66 3.7 30.3 1.0
C23 A:QNG301 3.9 26.3 0.2
C23 A:QNG301 4.0 25.9 0.5
C28 A:QNG301 4.0 28.5 0.2
C28 A:QNG301 4.0 28.5 0.5
CD A:GLN63 4.2 35.8 1.0
CG A:MET66 4.3 36.3 1.0
OE1 A:GLN63 4.4 34.0 1.0
O29 A:QNG301 4.4 28.4 0.2
N34 A:QNG301 4.4 31.3 0.5
O29 A:QNG301 4.4 28.4 0.5
N34 A:QNG301 4.5 31.0 0.2
OD1 A:ASN57 4.5 37.7 1.0
C35 A:QNG301 4.5 31.9 0.5
C35 A:QNG301 4.6 32.0 0.2
N43 A:QNG301 4.6 29.0 0.2
C20 A:QNG301 4.6 28.4 0.2
N43 A:QNG301 4.6 28.7 0.5
C20 A:QNG301 4.7 28.6 0.5
C24 A:QNG301 4.9 26.1 0.2
CA A:MET66 4.9 29.8 1.0
C A:MET66 4.9 29.0 1.0
O A:MET66 5.0 26.5 1.0
NZ A:LYS70 5.0 47.8 1.0
C24 A:QNG301 5.0 26.0 0.5

Fluorine binding site 6 out of 60 in 6vkv

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Fluorine binding site 6 out of 60 in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 6 of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F301

b:35.5
occ:0.25
F41 A:QNG301 0.0 35.5 0.2
F41 A:QNG301 0.1 36.0 0.5
C38 A:QNG301 1.4 33.7 0.2
C38 A:QNG301 1.4 33.8 0.5
F42 A:QNG301 2.2 33.6 0.2
F42 A:QNG301 2.3 33.7 0.5
C37 A:QNG301 2.3 34.2 0.5
C32 A:QNG301 2.4 31.8 0.5
C37 A:QNG301 2.4 34.1 0.2
C32 A:QNG301 2.4 31.9 0.2
F27 A:QNG301 2.5 30.1 0.2
F27 A:QNG301 2.6 30.9 0.5
C22 A:QNG301 3.1 27.9 0.2
C22 A:QNG301 3.2 27.8 0.5
N33 A:QNG301 3.2 29.7 0.5
N33 A:QNG301 3.2 29.8 0.2
NE2 A:GLN63 3.3 29.9 1.0
C31 A:QNG301 3.4 33.2 0.5
C39 A:QNG301 3.4 33.7 0.5
C31 A:QNG301 3.4 32.9 0.2
C39 A:QNG301 3.4 33.8 0.2
C36 A:QNG301 3.5 33.9 0.5
C36 A:QNG301 3.5 33.8 0.2
C30 A:QNG301 3.5 29.2 0.2
C30 A:QNG301 3.6 29.1 0.5
C21 A:QNG301 3.6 28.6 0.2
C21 A:QNG301 3.6 28.4 0.5
CB A:MET66 3.7 30.3 1.0
C23 A:QNG301 4.0 26.3 0.2
C28 A:QNG301 4.0 28.5 0.2
C28 A:QNG301 4.0 28.5 0.5
C23 A:QNG301 4.0 25.9 0.5
CD A:GLN63 4.2 35.8 1.0
OE1 A:GLN63 4.3 34.0 1.0
CG A:MET66 4.4 36.3 1.0
N34 A:QNG301 4.4 31.3 0.5
N34 A:QNG301 4.4 31.0 0.2
O29 A:QNG301 4.4 28.4 0.2
O29 A:QNG301 4.5 28.4 0.5
C35 A:QNG301 4.5 31.9 0.5
OD1 A:ASN57 4.5 37.7 1.0
C35 A:QNG301 4.5 32.0 0.2
N43 A:QNG301 4.6 29.0 0.2
N43 A:QNG301 4.7 28.7 0.5
C20 A:QNG301 4.7 28.4 0.2
C20 A:QNG301 4.7 28.6 0.5
CA A:MET66 4.9 29.8 1.0
C A:MET66 4.9 29.0 1.0
C24 A:QNG301 5.0 26.1 0.2
NZ A:LYS70 5.0 47.8 1.0

Fluorine binding site 7 out of 60 in 6vkv

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Fluorine binding site 7 out of 60 in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 7 of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F301

b:33.7
occ:0.51
F42 A:QNG301 0.0 33.7 0.5
F42 A:QNG301 0.1 33.6 0.2
C38 A:QNG301 1.4 33.8 0.5
C38 A:QNG301 1.4 33.7 0.2
F41 A:QNG301 2.2 36.0 0.5
F41 A:QNG301 2.3 35.5 0.2
C37 A:QNG301 2.4 34.2 0.5
C37 A:QNG301 2.4 34.1 0.2
C32 A:QNG301 2.4 31.9 0.2
C32 A:QNG301 2.4 31.8 0.5
CE A:LYS70 3.0 46.0 1.0
C22 A:QNG301 3.1 27.9 0.2
C22 A:QNG301 3.1 27.8 0.5
CD A:LYS70 3.2 44.3 1.0
NZ A:LYS70 3.3 47.8 1.0
C23 A:QNG301 3.3 26.3 0.2
O29 A:QNG301 3.3 28.4 0.2
C36 A:QNG301 3.3 33.8 0.2
C23 A:QNG301 3.3 25.9 0.5
C36 A:QNG301 3.3 33.9 0.5
O29 A:QNG301 3.3 28.4 0.5
C31 A:QNG301 3.3 32.9 0.2
C31 A:QNG301 3.3 33.2 0.5
N33 A:QNG301 3.4 29.8 0.2
N33 A:QNG301 3.4 29.7 0.5
C21 A:QNG301 3.4 28.6 0.2
F27 A:QNG301 3.4 30.9 0.5
CG A:LYS70 3.4 40.9 1.0
C21 A:QNG301 3.4 28.4 0.5
F27 A:QNG301 3.4 30.1 0.2
C28 A:QNG301 3.5 28.5 0.2
C28 A:QNG301 3.5 28.5 0.5
C24 A:QNG301 3.7 26.1 0.2
C30 A:QNG301 3.8 29.2 0.2
C24 A:QNG301 3.8 26.0 0.5
C30 A:QNG301 3.8 29.1 0.5
C20 A:QNG301 3.9 28.4 0.2
C39 A:QNG301 3.9 33.7 0.5
O A:MET66 3.9 26.5 1.0
C39 A:QNG301 3.9 33.8 0.2
C20 A:QNG301 3.9 28.6 0.5
C25 A:QNG301 4.0 27.3 0.2
C25 A:QNG301 4.1 27.3 0.5
N43 A:QNG301 4.2 29.0 0.2
N43 A:QNG301 4.2 28.7 0.5
C A:MET66 4.3 29.0 1.0
CB A:MET66 4.3 30.3 1.0
C35 A:QNG301 4.4 32.0 0.2
N34 A:QNG301 4.5 31.0 0.2
C35 A:QNG301 4.5 31.9 0.5
N34 A:QNG301 4.5 31.3 0.5
F26 A:QNG301 4.6 26.9 0.2
F26 A:QNG301 4.6 26.8 0.5
CB A:LYS70 4.6 36.9 1.0
C01 A:QNG301 4.7 29.6 0.2
C01 A:QNG301 4.7 29.8 0.5
N A:GLN67 4.8 28.4 1.0
OE1 A:GLN67 4.9 28.2 1.0
C19 A:QNG301 4.9 29.3 0.2
CA A:MET66 4.9 29.8 1.0
CA A:GLN67 4.9 32.1 1.0
C19 A:QNG301 5.0 29.0 0.5

Fluorine binding site 8 out of 60 in 6vkv

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Fluorine binding site 8 out of 60 in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 8 of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F301

b:33.6
occ:0.25
F42 A:QNG301 0.0 33.6 0.2
F42 A:QNG301 0.1 33.7 0.5
C38 A:QNG301 1.3 33.8 0.5
C38 A:QNG301 1.4 33.7 0.2
F41 A:QNG301 2.2 36.0 0.5
F41 A:QNG301 2.2 35.5 0.2
C37 A:QNG301 2.3 34.2 0.5
C37 A:QNG301 2.4 34.1 0.2
C32 A:QNG301 2.4 31.9 0.2
C32 A:QNG301 2.4 31.8 0.5
C22 A:QNG301 3.0 27.9 0.2
C22 A:QNG301 3.1 27.8 0.5
CE A:LYS70 3.1 46.0 1.0
CD A:LYS70 3.2 44.3 1.0
C23 A:QNG301 3.2 26.3 0.2
C36 A:QNG301 3.3 33.8 0.2
C23 A:QNG301 3.3 25.9 0.5
C36 A:QNG301 3.3 33.9 0.5
C31 A:QNG301 3.3 32.9 0.2
NZ A:LYS70 3.3 47.8 1.0
O29 A:QNG301 3.3 28.4 0.2
C31 A:QNG301 3.3 33.2 0.5
O29 A:QNG301 3.3 28.4 0.5
N33 A:QNG301 3.4 29.8 0.2
F27 A:QNG301 3.4 30.9 0.5
N33 A:QNG301 3.4 29.7 0.5
C21 A:QNG301 3.4 28.6 0.2
F27 A:QNG301 3.4 30.1 0.2
C21 A:QNG301 3.4 28.4 0.5
CG A:LYS70 3.5 40.9 1.0
C28 A:QNG301 3.5 28.5 0.2
C28 A:QNG301 3.5 28.5 0.5
C24 A:QNG301 3.7 26.1 0.2
C30 A:QNG301 3.8 29.2 0.2
C24 A:QNG301 3.8 26.0 0.5
C30 A:QNG301 3.8 29.1 0.5
C39 A:QNG301 3.8 33.7 0.5
O A:MET66 3.9 26.5 1.0
C39 A:QNG301 3.9 33.8 0.2
C20 A:QNG301 3.9 28.4 0.2
C20 A:QNG301 3.9 28.6 0.5
C25 A:QNG301 4.0 27.3 0.2
C25 A:QNG301 4.1 27.3 0.5
N43 A:QNG301 4.2 29.0 0.2
CB A:MET66 4.2 30.3 1.0
N43 A:QNG301 4.3 28.7 0.5
C A:MET66 4.3 29.0 1.0
C35 A:QNG301 4.5 32.0 0.2
N34 A:QNG301 4.5 31.0 0.2
C35 A:QNG301 4.5 31.9 0.5
N34 A:QNG301 4.5 31.3 0.5
F26 A:QNG301 4.6 26.9 0.2
F26 A:QNG301 4.6 26.8 0.5
CB A:LYS70 4.7 36.9 1.0
C01 A:QNG301 4.7 29.6 0.2
C01 A:QNG301 4.8 29.8 0.5
N A:GLN67 4.8 28.4 1.0
CA A:MET66 4.9 29.8 1.0
OE1 A:GLN67 4.9 28.2 1.0
C19 A:QNG301 4.9 29.3 0.2
CA A:GLN67 4.9 32.1 1.0
C19 A:QNG301 5.0 29.0 0.5

Fluorine binding site 9 out of 60 in 6vkv

Go back to Fluorine Binding Sites List in 6vkv
Fluorine binding site 9 out of 60 in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 9 of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F301

b:32.8
occ:0.51
F52 A:QNG301 0.0 32.8 0.5
F52 A:QNG301 0.9 32.1 0.2
C40 A:QNG301 1.4 31.9 0.5
C40 A:QNG301 1.5 32.0 0.2
F53 A:QNG301 1.8 33.1 0.2
F64 A:QNG301 2.2 31.4 0.5
F53 A:QNG301 2.2 33.9 0.5
C35 A:QNG301 2.3 31.9 0.5
C35 A:QNG301 2.3 32.0 0.2
F64 A:QNG301 2.7 31.6 0.2
C31 A:QNG301 2.9 33.2 0.5
C31 A:QNG301 2.9 32.9 0.2
C36 A:QNG301 3.4 33.9 0.5
C36 A:QNG301 3.5 33.8 0.2
N34 A:QNG301 3.5 31.0 0.2
N34 A:QNG301 3.5 31.3 0.5
C39 A:QNG301 4.1 33.8 0.2
C39 A:QNG301 4.2 33.7 0.5
C32 A:QNG301 4.2 31.9 0.2
O A:HOH413 4.2 39.6 1.0
C32 A:QNG301 4.2 31.8 0.5
N33 A:QNG301 4.4 29.8 0.2
N33 A:QNG301 4.5 29.7 0.5
C37 A:QNG301 4.8 34.1 0.2
C37 A:QNG301 4.8 34.2 0.5

Fluorine binding site 10 out of 60 in 6vkv

Go back to Fluorine Binding Sites List in 6vkv
Fluorine binding site 10 out of 60 in the Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 10 of Co-Crystal Structure of Gs-6207 Bound to Hiv-1 Capsid Hexamer within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F301

b:32.1
occ:0.25
F52 A:QNG301 0.0 32.1 0.2
F52 A:QNG301 0.9 32.8 0.5
C40 A:QNG301 1.4 32.0 0.2
C40 A:QNG301 1.4 31.9 0.5
F64 A:QNG301 1.7 31.4 0.5
F64 A:QNG301 2.2 31.6 0.2
F53 A:QNG301 2.2 33.1 0.2
C35 A:QNG301 2.4 32.0 0.2
C35 A:QNG301 2.4 31.9 0.5
F53 A:QNG301 2.6 33.9 0.5
C31 A:QNG301 2.9 32.9 0.2
C31 A:QNG301 2.9 33.2 0.5
C36 A:QNG301 3.2 33.9 0.5
C36 A:QNG301 3.2 33.8 0.2
O A:HOH413 3.4 39.6 1.0
N34 A:QNG301 3.7 31.0 0.2
N34 A:QNG301 3.7 31.3 0.5
C39 A:QNG301 4.1 33.8 0.2
C39 A:QNG301 4.1 33.7 0.5
C32 A:QNG301 4.2 31.9 0.2
C32 A:QNG301 4.3 31.8 0.5
N33 A:QNG301 4.6 29.8 0.2
N33 A:QNG301 4.6 29.7 0.5
C37 A:QNG301 4.7 34.1 0.2
C37 A:QNG301 4.7 34.2 0.5
OE1 A:GLN67 4.8 28.2 1.0
NZ A:LYS70 5.0 47.8 1.0

Reference:

S.M.Bester, G.Wei, H.Zhao, D.Adu-Ampratwum, N.Iqbal, V.V.Courouble, A.C.Francis, A.S.Annamalai, P.K.Singh, N.Shkriabai, P.Van Blerkom, J.Morrison, E.M.Poeschla, A.N.Engelman, G.B.Melikyan, P.R.Griffin, J.R.Fuchs, F.J.Asturias, M.Kvaratskhelia. Structural and Mechanistic Bases For A Potent Hiv-1 Capsid Inhibitor. Science V. 370 360 2020.
ISSN: ESSN 1095-9203
PubMed: 33060363
DOI: 10.1126/SCIENCE.ABB4808
Page generated: Fri Aug 2 03:08:28 2024

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