Fluorine in PDB, part 119 (files: 4721-4760),
PDB 5sb0-5sjo
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: 4721-4760 (PDB 5sb0-5sjo).
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5sb0 (F: 3) - DDR1, N-[[2-(2-Pyridin-3-Yloxyethyl)Cyclohexyl]Methyl]-3- (Trifluoromethoxy)Benzamide, 1.970A, P212121, Rfree=25.6%
Other atoms:
Cl (1);
I (1);
-
5sb4 (F: 1) - Tubulin-Todalam-8-Complex
Other atoms:
Ca (4);
Mg (5);
-
5sb5 (F: 1) - Tubulin-Todalam-9-Complex
Other atoms:
Mg (5);
Ca (4);
-
5sb6 (F: 1) - Tubulin-Todalam-10-Complex
Other atoms:
Ca (4);
Mg (5);
-
5sb7 (F: 3) - Tubulin-Todalam-18-Complex
Other atoms:
Mg (5);
Ca (4);
-
5sbp (F: 1) - CD44 Pandda Analysis Group Deposition -- the Hyaluronan-Binding Domain of CD44 in Complex with Z1229798311
-
5scx (F: 2) - Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-1190 (Racemic Mixture)
Other atoms:
Na (1);
-
5sd1 (F: 4) - Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-1235 (Enantiomer)
-
5sd2 (F: 2) - Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-1236 (Enantiomer)
-
5sd8 (F: 4) - Crystal Structure of Dihydrofolate Reductase From Homo Sapiens Bound to Nadp and Sddc Inhibitor Sddc-1190 (Racemic Mixture)
Other atoms:
Cl (1);
-
5sd9 (F: 1) - Crystal Structure of Dihydrofolate Reductase From Homo Sapiens Bound to Nadp and Sddc Inhibitor Sddc-1096
-
5sde (F: 2) - Pandda Analysis Group Deposition -- Crystal Structure of Porphyromonas Gingivalis in Complex with Z1619978933
Other atoms:
Cl (3);
-
5sdo (F: 3) - Pandda Analysis Group Deposition -- Crystal Structure of Porphyromonas Gingivalis in Complex with Z19735067
Other atoms:
Cl (3);
-
5sdp (F: 2) - Pandda Analysis Group Deposition -- Crystal Structure of Porphyromonas Gingivalis in Complex with Z2277255954
Other atoms:
Cl (3);
-
5sem (F: 12) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 3- Methyl-6-[2-(1-Methyl-4-Phenylimidazol-2-Yl)Ethyl]-2- (Trifluoromethyl)Imidazo[1,2-B]Pyridazine
Other atoms:
Mg (4);
Zn (4);
-
5ser (F: 4) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 4-N- (2-Fluoroethyl)-4-N,2-Dimethyl-3-N-(2-Phenyl-[1,2,4]Triazolo[1,5- A]Pyridin-7-Yl)Pyrazole-3,4-Dicarboxamide
Other atoms:
Zn (4);
Mg (4);
-
5seu (F: 18) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 2-[2- (2-Methyl-5-Pyrrolidin-1-Yl-1,2,4-Triazol-3-Yl)Ethyl]-6- (Trifluoromethyl)-[1,2,4]Triazolo[1,5-A]Pyridine
Other atoms:
Mg (4);
Zn (4);
-
5sf1 (F: 8) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 2- (Difluoromethyl)-3-Methyl-6-[2-(1-Methyl-4-Phenylimidazol-2-Yl) Ethynyl]Imidazo[1,2-B]Pyridazine
Other atoms:
Mg (4);
Zn (4);
-
5sfe (F: 7) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 3-N- [2-(3-Fluorophenyl)Imidazo[1,2-A]Pyrimidin-7-Yl]-4-N,4-N,2- Trimethylpyrazole-3,4-Dicarboxamide
Other atoms:
Zn (4);
Mg (4);
-
5sfk (F: 12) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 6- Cyclopropyl-3-(Pyrimidin-5-Ylamino)-N-[1-(2,2,2-Trifluoroethyl) Pyrazol-3-Yl]Pyridine-2-Carboxamide
Other atoms:
Mg (4);
Zn (4);
-
5sfq (F: 8) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 4- (Azetidine-1-Carbonyl)-N-[1-(2,2-Difluoroethyl)Pyrazol-3-Yl]-2- Methylpyrazole-3-Carboxamide
Other atoms:
Zn (4);
Mg (4);
-
5sfr (F: 4) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 4-N- Ethyl-3-N-[2-[3-(2-Fluoroethoxy)Phenyl]Imidazo[1,2-A]Pyrimidin-7-Yl]- 4-N,2-Dimethylpyrazole-3,4-Dicarboxamide
Other atoms:
Zn (4);
Mg (4);
-
5sg7 (F: 16) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 3-[2- (2-Fluorophenyl)Pyrazol-3-Yl]-1-[3-(Trifluoromethyl)Phenyl]Pyridazin- 4-One
Other atoms:
Mg (4);
Zn (4);
-
5sgm (F: 1) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 3-N- [2-(4-Fluorophenyl)Imidazo[1,2-A]Pyridin-7-Yl]-4-N,4-N,2- Trimethylpyrazole-3,4-Dicarboxamide
Other atoms:
Mg (1);
Zn (1);
-
5sgn (F: 12) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 2,3- Dimethyl-6-[2-(2-Methyl-5-Pyrrolidin-1-Yl-1,2,4-Triazol-3-Yl)Ethyl]- 7-(Trifluoromethyl)Imidazo[1,2-B]Pyridazine
Other atoms:
Zn (4);
Mg (4);
-
5sgo (F: 4) - Crystal Structure of Human Phosphodiesterase 10 in Complex with N-[3- [3-[5-(4-Fluorophenyl)Thieno[2,3-D]Pyrimidin-4- Yl]Oxypropoxy]Phenyl]Acetamide
Other atoms:
Zn (4);
-
5sgx (F: 12) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 5,8- Dimethyl-2-[2-[2-Methyl-5-[(2R)-2-(Trifluoromethyl)Pyrrolidin-1-Yl]- 1,2,4-Triazol-3-Yl]Ethyl]-[1,2,4]Triazolo[1,5-C]Pyrimidine
Other atoms:
Mg (4);
Zn (4);
-
5sh9 (F: 4) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 2-[2- [5-[(3R)-3-Fluoropyrrolidin-1-Yl]-2-Methyl-1,2,4-Triazol-3-Yl]Ethyl]- 5,8-Dimethyl-[1,2,4]Triazolo[1,5-A]Pyrazine
Other atoms:
Mg (4);
Zn (4);
-
5sha (F: 8) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 2-[2- [5-[3-(Difluoromethyl)Pyrrolidin-1-Yl]-2-Methyl-1,2,4-Triazol-3- Yl]Ethyl]-5,8-Dimethyl-[1,2,4]Triazolo[1,5-A]Pyrazine
Other atoms:
Zn (4);
Mg (4);
-
5shv (F: 3) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 1-(6- Fluoropyridin-2-Yl)Piperidin-4-One
Other atoms:
Zn (4);
Mg (4);
-
5si4 (F: 21) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 3-(2- Naphthalen-1-Ylpyrazol-3-Yl)-1-[3-(Trifluoromethoxy)Phenyl]Pyridazin- 4-One
Other atoms:
Zn (4);
Mg (4);
-
5sib (F: 12) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 3- Methyl-6-[2-(2-Methyl-5-Pyrrolidin-1-Yl-1,2,4-Triazol-3-Yl)Ethyl]-2- (Trifluoromethyl)Imidazo[1,2-B]Pyridazine
Other atoms:
Mg (4);
Zn (4);
-
5sif (F: 8) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 3-[2- (2,5-Difluorophenyl)Pyrazol-3-Yl]-1-(3-Methylsulfonylphenyl) Pyridazin-4-One
Other atoms:
Zn (4);
Cl (1);
Pr (8);
Mg (4);
-
5siw (F: 12) - 5-Methyl-2-[2-(2-Methyl-5-Pyrrolidin-1-Yl-1,2,4-Triazol-3-Yl)Ethyl]-8- (Trifluoromethyl)-[1,2,4]Triazolo[1,5-C]Pyrimidine
Other atoms:
Zn (4);
Mg (4);
-
5six (F: 1) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 5- [(3R)-3-Fluoropyrrolidin-1-Yl]-2-(3-Methylquinoxalin-2-Yl)-N-(Oxan-4- Yl)Pyrazolo[1,5-A]Pyrimidin-7-Amine
Other atoms:
Zn (1);
Mg (1);
-
5siy (F: 4) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 5- [(3R)-3-Fluoropyrrolidin-1-Yl]-N-Methyl-2-(3-Methylquinoxalin-2-Yl)- N-(Oxan-4-Yl)Pyrazolo[1,5-A]Pyrimidin-7-Amine
Other atoms:
Zn (4);
Mg (4);
-
5sje (F: 16) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 3-[2- (2,2-Difluoro-1,3-Benzodioxol-4-Yl)Pyrazol-3-Yl]-1-(3- Methylsulfonylphenyl)Pyridazin-4-One
Other atoms:
Pr (8);
Zn (4);
Cl (1);
Mg (4);
-
5sjf (F: 12) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 3-(2- Quinolin-4-Ylpyrazol-3-Yl)-1-[3-(Trifluoromethoxy)Phenyl]Pyridazin-4- One
Other atoms:
Mg (4);
Zn (4);
Cl (1);
-
5sjj (F: 12) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 4-N- Ethyl-5-[3-(Trifluoromethyl)Phenyl]-7H-Pyrrolo[2,3-D]Pyrimidine-2,4- Diamine
Other atoms:
Zn (4);
Mg (4);
-
5sjo (F: 20) - Crystal Structure of Human Phosphodiesterase 10 in Complex with 3-[2- (2,4-Difluorophenyl)Pyrazol-3-Yl]-1-[3-(Trifluoromethoxy) Phenyl]Pyridazin-4-One
Other atoms:
Mg (4);
Cl (1);
Zn (4);
Pr (8);
Page generated: Tue Feb 25 09:23:48 2025
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