Fluorine in PDB 6puw: Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Bictegravir (Bic)

The structure of Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Bictegravir (Bic) also contains other interesting chemical elements:

Magnesium	(Mg)	2 atoms
Zinc	(Zn)	2 atoms

The binding sites of Fluorine atom in the Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Bictegravir (Bic) (pdb code 6puw). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 3 binding sites of Fluorine where determined in the Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Bictegravir (Bic), PDB code: 6puw:
Jump to Fluorine binding site number: 1; 2; 3;

Fluorine binding site 1 out of 3 in the Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Bictegravir (Bic)


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Bictegravir (Bic) within 5.0Å range: probe atom residue distance (Å) B Occ A:F304 b:37.1 occ:1.00 FAE A:KLQ304 0.0 37.1 1.0 CAT A:KLQ304 1.4 37.1 1.0 CAI A:KLQ304 2.4 37.1 1.0 CAH A:KLQ304 2.4 37.1 1.0 NE2 A:GLN146 2.5 24.8 1.0 CD A:GLN146 2.8 18.6 1.0 CG A:GLN146 2.8 11.6 1.0 C6 E:DG18 2.9 8.9 1.0 N1 E:DG18 3.1 6.4 1.0 O6 E:DG18 3.2 10.1 1.0 C5 E:DG18 3.4 9.6 1.0 CAV A:KLQ304 3.6 37.1 1.0 CAU A:KLQ304 3.6 37.1 1.0 O A:HOH408 3.7 25.4 1.0 C2 E:DG18 3.7 7.3 1.0 OE1 A:GLN146 3.8 18.6 1.0 N A:GLN146 3.8 13.4 1.0 CA A:GLN146 3.8 12.3 1.0 C4 E:DG18 3.8 8.2 1.0 CB A:GLN146 3.9 11.0 1.0 N7 E:DG18 4.1 9.3 1.0 N3 E:DG18 4.1 8.6 1.0 CAY A:KLQ304 4.1 37.1 1.0 CG A:PRO145 4.3 10.9 1.0 C A:PRO145 4.3 12.2 1.0 N2 E:DG18 4.4 9.1 1.0 O E:HOH110 4.5 6.4 1.0 N3 F:DC20 4.6 14.5 1.0 CB A:PRO145 4.6 12.5 1.0 O A:PRO145 4.7 17.1 1.0 N9 E:DG18 4.7 9.0 1.0 N4 F:DC20 4.7 9.6 1.0 FAG A:KLQ304 4.7 37.1 1.0 FAF A:KLQ304 4.7 37.1 1.0 C8 E:DG18 4.8 11.2 1.0 C4 F:DC20 5.0 13.2 1.0

Fluorine binding site 2 out of 3 in the Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Bictegravir (Bic)


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Bictegravir (Bic) within 5.0Å range: probe atom residue distance (Å) B Occ A:F304 b:37.1 occ:1.00 FAF A:KLQ304 0.0 37.1 1.0 CAU A:KLQ304 1.4 37.1 1.0 CAY A:KLQ304 2.4 37.1 1.0 CAH A:KLQ304 2.4 37.1 1.0 CAK A:KLQ304 2.8 37.1 1.0 C2 F:DA21 3.0 19.9 0.6 N1 F:DA21 3.4 20.4 0.6 N3 F:DA21 3.4 20.8 0.6 OAA A:KLQ304 3.4 37.1 1.0 CAT A:KLQ304 3.6 37.1 1.0 CAV A:KLQ304 3.6 37.1 1.0 O A:HOH482 3.8 25.0 1.0 NAP A:KLQ304 3.9 37.1 1.0 C4 F:DA21 4.0 25.1 0.6 C6 F:DA21 4.1 21.7 0.6 C5 F:DC20 4.1 12.9 1.0 CAR A:KLQ304 4.1 37.1 1.0 N4 F:DC20 4.1 9.6 1.0 CAI A:KLQ304 4.1 37.1 1.0 C4 F:DC20 4.2 13.2 1.0 C5 F:DA21 4.4 26.7 0.6 CG A:PRO145 4.6 10.9 1.0 FAG A:KLQ304 4.7 37.1 1.0 FAE A:KLQ304 4.7 37.1 1.0 C6 F:DC20 4.8 15.3 1.0 O3' F:DA21 4.8 28.3 0.4 N6 F:DA21 4.9 14.3 0.6 N9 F:DA21 5.0 28.2 0.6 O E:HOH110 5.0 6.4 1.0

Fluorine binding site 3 out of 3 in the Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Bictegravir (Bic)


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 3 of Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Bictegravir (Bic) within 5.0Å range: probe atom residue distance (Å) B Occ A:F304 b:37.1 occ:1.00 FAG A:KLQ304 0.0 37.1 1.0 CAV A:KLQ304 1.4 37.1 1.0 CAY A:KLQ304 2.4 37.1 1.0 CAI A:KLQ304 2.4 37.1 1.0 NAP A:KLQ304 2.7 37.1 1.0 CAK A:KLQ304 2.8 37.1 1.0 CB A:GLU152 3.1 13.6 1.0 OE1 A:GLU152 3.1 21.7 1.0 CG A:GLU152 3.2 14.5 1.0 CD A:GLU152 3.3 21.6 1.0 C2' F:DC20 3.4 25.9 1.0 N1 F:DC20 3.6 37.1 1.0 C2 F:DC20 3.6 18.9 1.0 CAT A:KLQ304 3.6 37.1 1.0 CAU A:KLQ304 3.6 37.1 1.0 OAC A:KLQ304 3.7 37.1 1.0 O2 F:DC20 3.7 19.5 1.0 C1' F:DC20 3.8 27.6 1.0 CAR A:KLQ304 3.8 37.1 1.0 CB A:PRO145 4.0 12.5 1.0 C6 F:DC20 4.1 15.3 1.0 N3 F:DC20 4.1 14.5 1.0 CAH A:KLQ304 4.1 37.1 1.0 OE2 A:GLU152 4.2 25.2 1.0 CA A:GLU152 4.3 17.0 1.0 N2 E:DG18 4.5 9.1 1.0 CBA A:KLQ304 4.5 37.1 1.0 C4 F:DC20 4.5 13.2 1.0 OAA A:KLQ304 4.5 37.1 1.0 C5 F:DC20 4.6 12.9 1.0 CG A:PRO145 4.6 10.9 1.0 MG A:MG302 4.6 21.0 1.0 CAX A:KLQ304 4.6 37.1 1.0 FAF A:KLQ304 4.7 37.1 1.0 FAE A:KLQ304 4.7 37.1 1.0 C3' F:DC20 4.8 27.7 1.0 C A:GLU152 4.9 16.0 1.0 O A:PRO145 4.9 17.1 1.0

D.O.Passos, M.Li, I.K.Jozwik, X.Z.Zhao, D.Santos-Martins, R.Yang, S.J.Smith, Y.Jeon, S.Forli, S.H.Hughes, T.R.Burke Jr., R.Craigie, D.Lyumkis. Structural Basis For Strand Transfer Inhibitor Binding to Hiv Intasomes. Science 2020.
ISSN: ESSN 1095-9203
PubMed: 32001521
DOI: 10.1126/SCIENCE.AAY8015