Complexes after comparative docking

Receptor: model based on 2KZZ 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 7.5 0.42 0.6 DNA (5 -D(*GP*CP*TP*T*AP*CP*G)-3 ) 2KZZ Raw