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Chlorine in PDB, part 351 (files: 14001-14040), PDB 5qqv-5ras

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: 14001-14040 (PDB 5qqv-5ras).
  1. 5qqv (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Human ALAS2A in Complex with Z1545312521
  2. 5qrg (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Human Brachyury in Complex with Z275151340
    Other atoms: Cd (5);
  3. 5qs8 (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Human Brachyury G177D Variant in Complex with Z1432018343
    Other atoms: F (1);
  4. 5qtl (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of NUDT5 in Complex with Gb-0804
    Other atoms: F (12); Mg (8);
  5. 5qtm (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of NUDT5 in Complex with Fs-2639
    Other atoms: F (4); Mg (8);
  6. 5qtn (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of NUDT5 in Complex with Ss-4432
    Other atoms: F (3); Mg (8);
  7. 5qto (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of NUDT5 in Complex with 1R-0641
    Other atoms: F (20); Mg (8);
  8. 5qtp (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of NUDT5 in Complex with Ae-0227
    Other atoms: F (12); Mg (8);
  9. 5qtq (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of NUDT5 in Complex with Fs-1169
    Other atoms: F (4); Mg (8);
  10. 5qts (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of NUDT5 in Complex with 8J-537S
    Other atoms: F (12); Mg (8);
  11. 5qtt (Cl: 1) - Factor Xia in Complex with the Inhibitor Methyl [(3R,7S)-7-{[5-Amino- 1-(3-Chloro-2-Fluorophenyl)-1H-Pyrazole-4-Carbonyl]Amino}-3-Methyl-2- Oxo-2,3,4,5,6,7-Hexahydro-1H-12,8-(Metheno)-1,9- Benzodiazacyclotetradecin-15-Yl]Carbamate
    Other atoms: F (1);
  12. 5qtu (Cl: 1) - Factor Xia in Complex with the Inhibitor Methyl [(3R,7S)-7-{[1-(3- Chloro-2-Fluorophenyl)-5-Methyl-1H-Imidazole-4-Carbonyl]Amino}-3- Methyl-2-Oxo-2,3,4,5,6,7-Hexahydro-1H-12,8-(Metheno)-1,9- Benzodiazacyclotetradecin-15-Yl]Carbamate
    Other atoms: F (1);
  13. 5qtv (Cl: 1) - Factor Xia in Complex with the Inhibitor Methyl [(2R,7S)-7-({(2E)-3- [5-Chloro-2-(1H-Tetrazol-1-Yl)Phenyl]Prop-2-Enoyl}Amino)-2- (Trifluoromethyl)-2,3,4,5,6,7-Hexahydro-1H-8,11-Epimino-1,9- Benzodiazacyclotridecin-14-Yl]Carbamate
    Other atoms: F (3);
  14. 5qtw (Cl: 1) - Factor Xia in Complex with the Inhibitor Methyl (2R,7S)-7-({(2E)-3-[5- Chloro-2-(1H-Tetrazol-1-Yl)Phenyl]Prop-2-Enoyl}Amino)-14- [(Methoxycarbonyl)Amino]-2,3,4,5,6,7-Hexahydro-1H-8,11-Epimino-1,9- Benzodiazacyclotridecine-2-Carboxylate
  15. 5qtx (Cl: 1) - Factor Xia in Complex with the Inhibitor Ethyl (2R,7S)-7-({(2E)-3-[5- Chloro-2-(1H-Tetrazol-1-Yl)Phenyl]Prop-2-Enoyl}Amino)-14- [(Methoxycarbonyl)Amino]-1,2,3,4,5,6,7,9-Octahydro-11,8-(Azeno)-1,9- Benzodiazacyclotridecine-2-Carboxylate
  16. 5qty (Cl: 1) - Factor Xia in Complex with the Inhibitor Ethyl (2R,7S)-7-({(2E)-3-[5- Chloro-2-(1H-Tetrazol-1-Yl)Phenyl]Prop-2-Enoyl}Amino)-15- [(Methoxycarbonyl)Amino]-2,3,4,5,6,7-Hexahydro-1H-12,8-(Metheno)-1,9- Benzodiazacyclotetradecine-2-Carboxylate
  17. 5qu0 (Cl: 1) - Tgf-Beta Receptor Type 1 Kinase Domain (T204D) in Complex with 6-[4- (3-Chloro-4-Fluorophenyl)-1-(2-Hydroxyethyl)-1H-Imidazol-5- Yl]Imidazo[1,2-B]Pyridazine-3-Carbonitrile
    Other atoms: F (1);
  18. 5r7x (Cl: 5) - Pandda Analysis Group Deposition of Ground-State Model of Human JMJD1B
    Other atoms: Mn (2);
  19. 5r7y (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Covid-19 Main Protease in Complex with Z45617795
  20. 5r7z (Cl: 1) - Pandda Analysis Group Deposition -- Crystal Structure of Covid-19 Main Protease in Complex with Z1220452176
    Other atoms: F (1);
  21. 5r83 (Cl: 6) - Pandda Analysis Group Deposition -- Crystal Structure of Covid-19 Main Protease in Complex with Z44592329
  22. 5raa (Cl: 6) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with FM009990A
    Other atoms: Mn (2);
  23. 5rab (Cl: 6) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with FM001726A
    Other atoms: Mn (2);
  24. 5rac (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with FM001810A
    Other atoms: Mn (2);
  25. 5rad (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with FM001568A
    Other atoms: Mn (2);
  26. 5rae (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with FM001558A
    Other atoms: Mn (2);
  27. 5raf (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with FM001559A
    Other atoms: Mn (2);
  28. 5rag (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with FM001767A
    Other atoms: F (1); Mn (2);
  29. 5rah (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with FM010032A
    Other atoms: F (1); Mn (2);
  30. 5rai (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with XS040404C
    Other atoms: Mn (2);
  31. 5raj (Cl: 7) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with BD009815A
    Other atoms: Mn (2);
  32. 5rak (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with XS040486B
    Other atoms: Mn (2);
  33. 5ral (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with XS039332C
    Other atoms: Mn (2);
  34. 5ram (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with XS038544D
    Other atoms: Mn (2);
  35. 5ran (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with XS039080D
    Other atoms: Mn (2);
  36. 5rao (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with FM001084A
    Other atoms: Mn (2);
  37. 5rap (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with FM000707A
    Other atoms: Mn (2);
  38. 5raq (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with FM001577A
    Other atoms: Mn (2);
  39. 5rar (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with TD000005C
    Other atoms: Mn (2);
  40. 5ras (Cl: 5) - Pandda Analysis Group Deposition -- Crystal Structure of JMJD1B in Complex with XS036302B
    Other atoms: Mn (2);
Page generated: Wed Nov 4 04:00:42 2020

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