Fluorine in PDB, part 245 (files: 9761-9800),
PDB 8t5v-8tsi
Experimental structures of coordination spheres of Fluorine (F) in bioorganic
molecules from X-Ray and NMR experiments. Coordination spheres were calculated with 5.0 Angstroms radius
around Fluorine atoms. PDB files: 9761-9800 (PDB 8t5v-8tsi).
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8t5v (F: 2) - Influenza Pa-N Endonuclease A36V Mutant with Baloxavir
Other atoms:
Mn (2);
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8t5w (F: 4) - Influenza Pan Endonuclease I38T Mutant with Baloxavir
Other atoms:
Mn (2);
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8t6f (F: 1) - Crystal Structure of Human Mbp-Myeloid Cell Leukemia 1 (Mcl-1) in Complex with BRD810 Inhibitor
Other atoms:
Cl (1);
Mg (1);
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8t6z (F: 3) - Influenza Pan Endonuclease I38T Mutant with 6-(4-(1H-Tetrazol-5-Yl)-2- (Trifluoromethyl)Phenyl)-3-Hydroxy-4-Oxo-1,4-Dihydropyridine-2- Carboxylic Acid
Other atoms:
Mn (2);
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8t7o (F: 3) - Crystal Structure of the R132H Mutant of IDH1 Bound to Ag-120
Other atoms:
Cl (1);
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8t81 (F: 3) - Influenza Pan Endonuclease E23K Mutant with 6-(4-(1H-Tetrazol-5-Yl)-2- (Trifluoromethyl)Phenyl)-3-Hydroxy-4-Oxo-1,4-Dihydropyridine-2- Carboxylic Acid
Other atoms:
Mn (2);
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8t82 (F: 5) - Racemic Mixture of Amyloid Beta Segment 35-Mvggvv-40 Forms Heterochiral Rippled Beta-Sheet, Includes Pentafluoropropionic Acid
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8t85 (F: 3) - Structure of Rssb Bound to Beryllofluoride
Other atoms:
Mg (1);
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8t89 (F: 3) - Racemic Mixture of Amyloid Beta Segment 16-Klvffa-21 Forms Heterochiral Rippled Beta-Sheet
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8t8q (F: 2) - Identification of Gdc-1971 (Rly-1971), A SHP2 Inhibitor Designed For the Treatment of Solid Tumors
Other atoms:
Cl (2);
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8t94 (F: 3) - Influenza Pan Endonuclease with 6-(4-(1H-Tetrazol-5-Yl)-2- (Trifluoromethyl)Phenyl)-3-Hydroxy-4-Oxo-1,4-Dihydropyridine-2- Carboxylic Acid
Other atoms:
Mn (2);
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8t98 (F: 1) - Diphosphoinositol Polyphosphate Phosphohydrolase 1 (DIPP1/NUDT3) in Complex with Scyllo-3-Pp-(1,2,4,5)IP4, Mg, and Fluoride Ion
Other atoms:
Mg (3);
Cl (2);
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8t99 (F: 1) - Diphosphoinositol Polyphosphate Phosphohydrolase 1 (DIPP1/NUDT3) in Complex with Scyllo-L-1,4-[Pp]2-(2,3)IP2, Mg, and Fluoride Ion
Other atoms:
Cl (2);
Mg (3);
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8t9v (F: 1) - Rta-Runt-59 Complex Structure
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8tav (F: 9) - Fphh, Staphylococcus Aureus Fluorophosphonate-Binding Serine Hydrolases H, Boronic Acid-Based Compound N34 Bound
Other atoms:
Ca (5);
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8tb7 (F: 2) - Cryo-Em Structure of GPR61-
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8tcy (F: 2) - Structure of PYCR1 Complexed with 7-Fluoro-2-Oxo-1,2,3,4- Tetrahydroquinoline-6-Carboxylic Acid
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8tdu (F: 14) - Stx-478, A Mutant-Selective, Allosteric Inhibitor Bound to PI3KALPHA
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8tf9 (F: 1) - Diphosphoinositol Polyphosphate Phosphohydrolase 1 (DIPP1/NUDT3) in Complex with Myo-5-IP7, Produced Upon Myo-IP6 Phosphorylation By Tvi
Other atoms:
Mg (3);
Cl (2);
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8tfa (F: 1) - Diphosphoinositol Polyphosphate Phosphohydrolase 1 (DIPP1/NUDT3) in Complex with Myo-5-Pp-IP4, Produced Upon Myo-(2OH)-IP5 Phosphorylation By Tvipk
Other atoms:
Mg (3);
Cl (1);
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8tff (F: 12) - Porx with BEF3 Phosphate Analog
Other atoms:
Ca (7);
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8tfw (F: 6) - Fphe, Staphylococcus Aureus Fluorophosphonate-Binding Serine Hydrolases E, Boronic Acid-Based Compound N34 Bound
Other atoms:
Mg (1);
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8tgd (F: 14) - Stx-478, A Mutant-Selective, Allosteric Inhibitor Bound to H1047R PI3KALPHA
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8thg (F: 3) - Cryo-Em Structure of NAV1.7 with Rlz
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8tjv (F: 1) - Tetrahymena Ribozyme Scaffolded Fluoride Riboswitch
Other atoms:
K (1);
Mg (30);
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8tk2 (F: 4) - Human VH1-Related Dual-Specificity Phosphatase (Vhr) Complexed with 2- ((2,4-Difluorobenzyl)Amino)-2-Oxoacetic Acid
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8tk3 (F: 4) - Human VH1-Related Dual-Specificity Phosphatase (Vhr) Having Oxidized Catalytic Cysteine and Complexed with 6-(Difluoromethyl)Pyrimidin-4- Ol at Two Allosteric Sites
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8tlc (F: 1) - Human Mitochondrial Serine Hydroxymethyltransferase (SHMT2) in Complex with Plp, Glycine and Tri-Glutamate AGF347 Inhibitor
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8tlr (F: 2) - Crystal Structure of Human Hras G12C Covalently Bound to Amg 510
Other atoms:
Mg (1);
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8tn6 (F: 3) - De Novo Designed Protein Binds Poly Adp Ribose Polymerase Inhibitors (Parpi) - Holo Rucaparib
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8tnb (F: 3) - De Novo Designed Protein Binds Poly Adp Ribose Polymerase Inhibitors (Parpi) - Holo Mefuparib
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8tov (F: 24) - Hiv-Ca Disulfide Linked Hexamer Bound to Quinazolin-4-One Scaffold Inhibitor
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8tqp (F: 24) - Hiv-Ca Disulfide Linked Hexamer Bound to Quinazolin-4-One Scaffold Inhibitor
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8tra (F: 9) - Cryo-Em Structure of the Rat P2X7 Receptor in Complex with the Allosteric Antagonist GSK1482160
Other atoms:
Na (1);
Cl (3);
Zn (6);
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8ts9 (F: 4) - Human PI3K P85ALPHA/P110ALPHA H1047R Bound to Compound 1
-
8tsa (F: 1) - Human PI3K P85ALPHA/P110ALPHA H1047R Bound to Compound 2
Other atoms:
Br (1);
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8tsb (F: 1) - Human PI3K P85ALPHA/P110ALPHA Bound to Compound 2
Other atoms:
Br (1);
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8tsc (F: 4) - Human PI3K P85ALPHA/P110ALPHA H1047R Bound to Compound 3
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8tsd (F: 5) - Human PI3K P85ALPHA/P110ALPHA Bound to Rly-2608
Other atoms:
Cl (1);
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8tsi (F: 8) - S. Thermodepolymerans Kpsmt-Kpse in Complex with Adp:ALF4-
Other atoms:
Al (2);
Page generated: Wed Nov 13 08:17:22 2024
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