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Table 1 Protein-ligand interactions obtained by LIGPLOT analysis of X-ray and QXP docked complexes. Bold and underlined: Residues shared by p,p- and o,p-isomers respectively for each receptor.

From: Modelling the interaction of steroid receptors with endocrine disrupting chemicals

  hERa hPR rAR
Estradiol L346,E353,L387,M388, R394,
F404,M421,H524L525,L539
  
Progesterone   L718,N719,Q725,M759,
R766,L797,M801,Y890,
C891,T894,M909
 
Testosterone    L704,N705,L707,G708,
Q711,M742,M745,M749,
R752,F764,M780,M787,
F876,T877, F891,M895
p,p-DDT W383,L384,L387,G521,L525,
A350,L391
L715,L718,F778
N719,G722,F905
M745,F764,M780
L704,L707,W741
p,p-DDE W383,L384,L387,G521, L525
F404
L715,L718,F778 M756 M745,F764,M780
W741, M742, L873, T877
p,p-DDD W383,L384,L387 G521, L525
L346, A350, F404,L540
L715,L718,F778
C891, F905, M909
M745, F764,M780
L704, L707, M787,L873
o,p-DDT L346,A350, F404,M421
M343,L349,L384,L387,M388,
I424,F425,L428,G521,H524,
L525
L718,F778
L715,N719,G722,W755,
M756,M759,F794,M801
T894,V903,F905,M909
L704, F764,M780,L873
L707, M787
o,p-DDE L346,A350,F404,M421,
M343,L525
L718, F778
T890, C891, T894, F905
L704, F764,M780,L873
W741, M745, F876, T877
o,p-DDD L346,A350, F404,M421
L384, L387, M388, I424, F425,
L428
L718, F778
L721, M759, F794, L797,
Y890, M909
L704, F764,M780,L873
L707,M742, M745,F876
PCB-OH M343,L346,T347,A350 L387,
M388,L391,F404 G521,H524
L715,L718,L721,V760,
L763,F778, L797,M801
Y890,C891
L701,L704,N705,L707,
Q711,W741,M742 M745,
F764,L873,F876