Complexes after comparative docking

Receptor: model based on 1EMH chain:A
& Ligands found in homologous templates


Theoretical pKd : [ ‹nMol | ‹μMol | ‹mMol | ›mMol] - Values:

Score for Scwrl (Unconserved side chains of binding site are recalculated) model :

Result RMS (ca) pKd Avg. Q PSim Ligand Name : Origin Transfer
NACID_B_1 0.000 10.4 0.28 7.4 DNA (5 -D(*TP*GP*TP*(P2U)P*AP*TP*CP*TP*T)-3 ) 1EMH Raw
NACID_C_2 0.000 3.6 0.43 0.8 DNA (5 -D(*AP*AP*AP*GP*AP*TP*AP*AP*CP*A)-3 ) 1EMH Raw