Compile Data Set for Download or QSAR

Found 29 hits with non-zero delta_G for polymer = 1646,3984

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM15359 ((4E,6Z,8S,9S,10E,12S,13R,14S,16R)-13-hydroxy-8,14-...)	GoogleScholar PDB	PC cid PC sid		-7.74	-3.25	-4.61	6.03	8	10
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM31996 (17-(dimethylaminoethylamino)-17-demethoxygeldanamy...)	GoogleScholar PDB	PC cid PC sid PDB		-7.62	-2.77	-4.87	5.80	8	15
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM31996 (17-(dimethylaminoethylamino)-17-demethoxygeldanamy...)	GoogleScholar PDB	PC cid PC sid PDB		-7.57	-1.93	-5.64	5.65	8	20
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM31996 (17-(dimethylaminoethylamino)-17-demethoxygeldanamy...)	GoogleScholar PDB	PC cid PC sid PDB		-7.69	-1.82	-5.88	5.64	8	25
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM15359 ((4E,6Z,8S,9S,10E,12S,13R,14S,16R)-13-hydroxy-8,14-...)	GoogleScholar PDB	PC cid PC sid		-7.69	-1.48	-6.21	5.88	8	15
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM20740 (Geldanamycin)	GoogleScholar PDB	MMDB PC cid PC sid PDB		-7.95	-1.20	-6.76	6.15	8	10
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM15359 ((4E,6Z,8S,9S,10E,12S,13R,14S,16R)-13-hydroxy-8,14-...)	GoogleScholar PDB	PC cid PC sid		-7.67	-1.17	-6.50	5.73	8	20
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM31996 (17-(dimethylaminoethylamino)-17-demethoxygeldanamy...)	GoogleScholar PDB	PC cid PC sid PDB		-7.71	-1.03	-6.71	5.60	8	30
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM15359 ((4E,6Z,8S,9S,10E,12S,13R,14S,16R)-13-hydroxy-8,14-...)	GoogleScholar PDB	PC cid PC sid		-7.62	-0.768	-6.85	5.51	8	30
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM20740 (Geldanamycin)	GoogleScholar PDB	MMDB PC cid PC sid PDB		-8.26	-0.523	-7.74	6.23	8	15
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM20740 (Geldanamycin)	GoogleScholar PDB	MMDB PC cid PC sid PDB		-8.29	-0.427	-7.86	6.15	8	20
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM20740 (Geldanamycin)	GoogleScholar PDB	MMDB PC cid PC sid PDB		-8.14	0.0712	-8.22	5.98	8	25
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM20740 (Geldanamycin)	GoogleScholar PDB	MMDB PC cid PC sid PDB		-8.07	0.384	-8.46	5.88	8	30
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM18134 (({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-...)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-5.48	2.33	-7.81	3.93	8	25
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM18134 (({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-...)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-5.30	2.68	-7.98	3.89	8	25
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM18134 (({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-...)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-5.47	2.72	-8.20	4.15	8	16
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM18134 (({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-...)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-5.40	2.77	-8.17	4.04	8	20
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM18134 (({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-...)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-5.56	2.97	-8.52	4.26	8	12
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM18134 (({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-...)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-5.57	3.10	-8.67	4.28	8	10
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM18134 (({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-...)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-5.45	3.13	-8.57	4.11	8	15
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM18134 (({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-...)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-5.59	3.42	-9.02	4.34	8	8
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM18134 (({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-...)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-5.61	3.56	-9.17	4.36	8	8
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM10851 ((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)	GoogleScholar PDB	CHEBI KEGG PC cid PC sid PDB		-5.09	4.97	-10.1	3.70	8	25
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM10851 ((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)	GoogleScholar PDB	CHEBI KEGG PC cid PC sid PDB		-5.61	5.80	-11.4	4.34	8	10
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM10851 ((4aR,6R,7R,7aS)-6-(6-amino-9H-purin-9-yl)-2,7-dihy...)	GoogleScholar PDB	CHEBI KEGG PC cid PC sid PDB		-5.40	6.07	-11.5	4.08	8	15
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM31995 (ADP | Adenosine Diphosphate (ADP) | CHEMBL14830)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-6.26	10.8	-17.1	4.67	8	20
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM31995 (ADP | Adenosine Diphosphate (ADP) | CHEMBL14830)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-6.45	10.9	-17.3	4.95	8	10
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM31995 (ADP | Adenosine Diphosphate (ADP) | CHEMBL14830)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-6.47	11.0	-17.5	4.90	8	16
University College London					J Mol Biol 392: 923-36 (2009)
Heat Shock Protein 90 (Hsp90) (Saccharomyces cerevisiae (Baker s yeast))	BDBM31995 (ADP | Adenosine Diphosphate (ADP) | CHEMBL14830)	GoogleScholar PDB	CHEBI KEGG MMDB PC cid PC sid PDB		-6.52	11.4	-18.0	4.95	8	15
University College London					J Mol Biol 392: 923-36 (2009)

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