Chlorine in PDB, part 355 (files: 14161-14200),
PDB 5s2w-5sd8
Experimental structures of coordination spheres of Chlorine (Cl) in bioorganic
molecules from X-Ray and NMR experiments. Coordination spheres were calculated with 5.0 Angstroms radius
around Chlorine atoms. PDB files: 14161-14200 (PDB 5s2w-5sd8).
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5s2w (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Sars-Cov-2 NSP3 Macrodomain in Complex with Z1407672867
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5s2y (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Sars-Cov-2 NSP3 Macrodomain in Complex with Z19727416
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5s33 (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Sars-Cov-2 NSP3 Macrodomain in Complex with Z906021418
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5s4i (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Sars-Cov-2 NSP3 Macrodomain in Complex with SF051
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5s4j (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Sars-Cov-2 NSP3 Macrodomain in Complex with SF054
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5s4p (Cl: 5) - Tubulin-Z275165822-Complex
Other atoms:
Ca (4);
Mg (5);
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5s5b (Cl: 1) - Tubulin-Z906021418-Complex
Other atoms:
Ca (4);
Mg (5);
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5s5m (Cl: 2) - Tubulin-Z45527714-Complex
Other atoms:
Ca (4);
Mg (5);
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5s5v (Cl: 1) - Tubulin-Z32386228-Complex
Other atoms:
Mg (5);
Ca (4);
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5s8j (Cl: 1) - Xchem Group Deposition -- Crystal Structure of the Second Bromodomain of Pleckstrin Homology Domain Interacting Protein (Phip) in Complex with N01207D (Space Group C2)
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5s8o (Cl: 1) - Xchem Group Deposition -- Crystal Structure of the Second Bromodomain of Pleckstrin Homology Domain Interacting Protein (Phip) in Complex with N01460C (Space Group P212121)
Other atoms:
Ca (2);
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5s8x (Cl: 2) - Pandda Analysis Group Deposition -- Crystal Structure of Phip in Complex with Starting Material
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5s93 (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Phip in Complex with Z198194396 Synthetic Derivative
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5s95 (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Phip in Complex with Z198194396 Synthetic Derivative
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5s9a (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Phip in Complex with Z198194396 Synthetic Derivative
Other atoms:
F (3);
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5s9l (Cl: 2) - Autotaxin, 4-[3-Oxo-3-(2-Oxo-2,3-Dihydro-Benzooxazol-6-Yl)-Propyl]- Piperazine-1-Carboxylic Acid 3,5-Dichloro-Benzyl Ester, 1.90A, P212121, Rfree=19.1%
Other atoms:
Zn (1);
Ca (2);
K (1);
Na (1);
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5s9m (Cl: 3) - Autotaxin, (3,5-Dichlorophenyl)Methyl (3AS,8AR)-2-(1H-Benzotriazole-5- Carbonyl)-1,3,3A,4,5,7,8,8A-Octahydropyrrolo[3,4-D]Azepine-6- Carboxylate, 1.80A, P212121, Rfree=21.1%
Other atoms:
Zn (2);
Ca (3);
Na (1);
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5s9n (Cl: 4) - Autotaxin, [4-(Trifluoromethoxy)Phenyl]Methyl (3AS,6AS)-2-(1H- Benzotriazole-5-Carbonyl)-1,3,3A,4,6,6A-Hexahydropyrrolo[3,4- C]Pyrrole-5-Carboxylate, 1.80A, P212121, Rfree=23.3%
Other atoms:
Zn (1);
Ca (2);
Na (1);
F (3);
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5sa8 (Cl: 2) - Pandda Analysis Group Deposition -- Crystal Structure of Sars-Cov-2 Nendou in Complex with Z68299550
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5sas (Cl: 3) - Endothiapepsin in Complex with Compound FU290-2
Other atoms:
Br (1);
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5saz (Cl: 3) - DDR1, 3-Chloro-N-[4-Chloro-3-(1H-Pyrrolo[2,3-B]Pyridin-5-Ylcarbamoyl) Phenyl]-4-(2-Hydroxyethylamino)Benzamide, 1.802A, P212121, Rfree=22.2%
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5sb0 (Cl: 1) - DDR1, N-[[2-(2-Pyridin-3-Yloxyethyl)Cyclohexyl]Methyl]-3- (Trifluoromethoxy)Benzamide, 1.970A, P212121, Rfree=25.6%
Other atoms:
I (1);
F (3);
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5sb1 (Cl: 1) - DDR1, 4-Chloro-N-[(3S,4R)-4-Phenylpyrrolidin-3-Yl]-3-(1H-Pyrrolo[2,3- B]Pyridin-5-Yloxymethyl)Benzamide, 1.530A, P212121, Rfree=21.4%
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5sb2 (Cl: 1) - DDR1, 3-Chloro-N-[(1R,2S)-2-Phenylcyclopropyl]-5-(1H-Pyrrolo[2,3- B]Pyridin-5-Yloxymethyl)Benzamide, 1.600A, P212121, Rfree=23.2%
Other atoms:
I (5);
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5sb8 (Cl: 1) - Tubulin-Maytansinoid-3-Complex
Other atoms:
Mg (5);
Ca (3);
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5sb9 (Cl: 1) - Tubulin-Maytansinoid-4A-Complex
Other atoms:
Mg (5);
Ca (3);
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5sba (Cl: 1) - Tubulin-Maytansinoid-4B-Complex
Other atoms:
Ca (3);
Mg (5);
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5sbb (Cl: 1) - Tubulin-Maytansinoid-4C-Complex
Other atoms:
Ca (4);
Mg (5);
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5sbc (Cl: 1) - Tubulin-Maytansinoid-5A-Complex
Other atoms:
Mg (5);
Ca (4);
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5sbd (Cl: 1) - Tubulin-Maytansinoid-5B-Complex
Other atoms:
Mg (5);
Ca (4);
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5sbe (Cl: 1) - Tubulin-Maytansinoid-5C-Complex
Other atoms:
Mg (5);
Ca (3);
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5scp (Cl: 1) - Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-23
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5scv (Cl: 2) - Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-889
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5scw (Cl: 3) - Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-916
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5scz (Cl: 1) - Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-1224
Other atoms:
Na (1);
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5sd0 (Cl: 1) - Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-1225
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5sd4 (Cl: 1) - Crystal Structure of Dihydrofolate Reductase From Mycobacterium Tuberculosis Bound to Nadp and Sddc Inhibitor Sddc-1218
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5sd6 (Cl: 3) - Crystal Structure of Dihydrofolate Reductase From Homo Sapiens Bound to Nadp and Sddc Inhibitor Sddc-892
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5sd7 (Cl: 1) - Crystal Structure of Dihydrofolate Reductase From Homo Sapiens Bound to Nadp and Sddc Inhibitor Sddc-735
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5sd8 (Cl: 1) - Crystal Structure of Dihydrofolate Reductase From Homo Sapiens Bound to Nadp and Sddc Inhibitor Sddc-1190 (Racemic Mixture)
Other atoms:
F (4);
Page generated: Thu Dec 28 02:24:37 2023
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