Fluorine in PDB, part 51 (files: 2001-2040),
PDB 3sb0-3sym
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: 2001-2040 (PDB 3sb0-3sym).
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3sb0 (F: 1) - Crystal Structure of Mycobacterium Tuberculosis Malate Synthase in Complex with 4-(2-Chloro-6-Fluoro-3-Methylphenyl)-2,4-Dioxobutanoic Acid Inhibitor
Other atoms:
Mg (3);
Cl (1);
-
3sco (F: 2) - Crystal Structure of Rice BGLU1 E386G Mutant Complexed with Alpha- Glucosyl Fluoride
Other atoms:
Zn (1);
-
3scq (F: 2) - Crystal Structure of Rice BGLU1 E386A Mutant Complexed with Alpha- Glucosyl Fluoride
Other atoms:
Zn (1);
-
3scs (F: 2) - Crystal Structure of Rice BGLU1 E386S Mutant Complexed with Alpha- Glucosyl Fluoride
Other atoms:
Zn (1);
-
3sd0 (F: 2) - Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice
Other atoms:
I (2);
-
3sd5 (F: 3) - Crystal Structure of PI3K Gamma with 5-(2,4-Dimorpholinopyrimidin-6- Yl)-4-(Trifluoromethyl)Pyridin-2-Amine
-
3sd8 (F: 2) - Crystal Structure of Ara-Fhna Decamer Dna
Other atoms:
Sr (1);
-
3sdg (F: 3) - Ethionamide Boosters Part 2: Combining Bioisosteric Replacement and Structure-Based Drug Design to Solve Pharmacokinetic Issues in A Series of Potent 1,2,4-Oxadiazole Ethr Inhibitors.
-
3sfc (F: 3) - Structure-Based Optimization of Potent 4- and 6-Azaindole-3- Carboxamides As Renin Inhibitors
-
3sff (F: 2) - Crystal Structure of Human HDAC8 Inhibitor Complex, An Amino Acid Derived Inhibitor
Other atoms:
K (2);
Zn (1);
Cl (1);
-
3sfi (F: 3) - Ethionamide Boosters Part 2: Combining Bioisosteric Replacement and Structure-Based Drug Design to Solve Pharmacokinetic Issues in A Series of Potent 1,2,4-Oxadiazole Ethr Inhibitors.
-
3sfk (F: 5) - Crystal Structure of Plasmodium Falciparum Dihydroorotate Dehydrogenase Bound with Inhibitor DSM267
-
3sgu (F: 1) - Crystal Structure of Methanothermobacter Thermautotrophicus Orotidine 5'-Monophosphate Decarboxylase Covalently Modified By 5-Fluoro-6- Iodo-Ump
-
3she (F: 3) - Novel Atp-Competitive MK2 Inhibitors with Potent Biochemical and Cell- Based Activity Throughout the Series
-
3shy (F: 1) - Crystal Structure of the PDE5A1 Catalytic Domain in Complex with Novel Inhibitors
Other atoms:
Mg (3);
Zn (1);
-
3sji (F: 1) - Crystal Structure of CVA16 3C in Complex with Rupintrivir (AG7088)
Other atoms:
Na (1);
-
3sjo (F: 8) - Structure of EV71 3C in Complex with Rupintrivir (AG7088)
-
3ska (F: 6) - I. Novel Hcv NS5B Polymerase Inhibitors: Discovery of Indole 2- Carboxylic Acids with C3-Heterocycles
-
3skc (F: 4) - Human B-Raf Kinase in Complex with An Amide Linked Pyrazolopyridine Inhibitor
-
3ske (F: 6) - I. Novel Hcv NS5B Polymerase Inhibitors: Discovery of Indole 2- Carboxylic Acids with C3-Heterocycles
-
3skg (F: 8) - Crystal Structure of Beta-Site App-Cleaving Enzyme 1 (Bace-Wt) Complex with (2S)-2-((3R)-3-Acetamido-3-Isobutyl-2-Oxo-1-Pyrrolidinyl)-N- ((1S,2R)-1-(3,5-Difluorobenzyl)-2-Hydroxy-2-(1,2,3,4-Tetrahydro-3- Isoquinolinyl)Ethyl)-4-Phenylbutanamide
-
3skh (F: 2) - I. Novel Hcv NS5B Polymerase Inhibitors: Discovery of Indole 2- Carboxylic Acids with C3-Heterocycles
Other atoms:
Cl (2);
-
3skk (F: 4) - Crystal Structure of Human Arginase I in Complex with the Inhibitor Fabh, Resolution 1.70 A, Twinned Structure
Other atoms:
Mn (4);
-
3sl0 (F: 2) - Crystal Structure of P. Falciparum Arginase Complexed with 2-Amino-6- Borono-2-(Difluoromethyl)Hexanoic Acid
Other atoms:
Mn (2);
-
3sls (F: 2) - Crystal Structure of Human Mek-1 Kinase in Complex with UCB1353770 and Amppnp
Other atoms:
Mg (2);
I (2);
-
3sn7 (F: 2) - Highly Potent, Selective, and Orally Active Phosphodiestarase 10A Inhibitors
Other atoms:
Mg (2);
Zn (2);
Cl (2);
-
3snl (F: 3) - Highly Potent, Selective, and Orally Active Phosphodiestarase 10A Inhibitors
Other atoms:
Mg (2);
Zn (2);
Cl (1);
-
3spk (F: 6) - Tipranavir in Complex with A Human Immunodeficiency Virus Type 1 Protease Variant
-
3sr0 (F: 8) - Crystal Structure of the Phosphoryl Transfer Transition State Mimic in the Adenylate Kinase: Adp/ALF4/Amp in the Active Site
Other atoms:
Mg (2);
Al (2);
-
3ss8 (F: 8) - Crystal Structure of Nfeob From S. Thermophilus Bound to Gdp.ALF4- and K+
Other atoms:
Mg (2);
Al (2);
K (2);
-
3ssa (F: 1) - Crystal Structure of Subunit B Mutant N157T of the A1AO Atp Synthase
Other atoms:
Cl (3);
-
3ssj (F: 1) - Crystal Structure of Methanothermobacter Thermautotrophicus Orotidine 5'-Monophosphate Decarboxylase Complexed with 5-Fluoro-6-Amino-Ump
-
3ssv (F: 1) - Engineered Low-Affinity Halide-Binding Protein Derived From Yfp: Fluoride Complex
-
3su0 (F: 1) - Crystal Structure of NS3/4A Protease Variant R155K in Complex with Danoprevir
Other atoms:
Zn (1);
-
3su1 (F: 1) - Crystal Structure of NS3/4A Protease Variant D168A in Complex with Danoprevir
Other atoms:
Zn (1);
-
3su2 (F: 1) - Crystal Structure of NS3/4A Protease Variant A156T in Complex with Danoprevir
Other atoms:
Zn (1);
-
3svp (F: 6) - Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((3R,4R)-4-(2-((2,2-Difluoro-2-(3-Chloro-5-Fluorophenyl) Ethyl)Amino)Ethoxy)Pyrrolidin-3-Yl)Methyl)-4-Methylpyridin-2-Amine
Other atoms:
Zn (1);
Fe (2);
Cl (2);
-
3svq (F: 8) - 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
Other atoms:
Fe (2);
Zn (1);
-
3sw6 (F: 1) - Crystal Structure of Methanothermobacter Thermautotrophicus Orotidine 5'-Monophosphate Decarboxylase Covalently Modified By 5-Fluoro-6- Azido-Ump
-
3sym (F: 1) - Glycogen Phosphorylase B in Complex with 3 -C-(Hydroxymethyl)-Beta-D- Glucopyranonucleoside of 5-Fluorouracil
Page generated: Mon Aug 4 21:45:15 2025
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