CCL: Docking studies with multiple crystal structures of a protein

From: Prija Ponnan <prija.ponnan=-=gmail.com>
Subject: CCL: Docking studies with multiple crystal structures of a protein
Date: Wed, 21 Mar 2012 21:51:05 +0530

Hello all

Its a general query not directly related to Autodock usage.I want to study interaction of certain coumarin molecules with INHA

(Enoyl-[acyl-carrier-protein] reductase [NADH]) of Mycobacterium tuberculosis

In PDB database 36 crystal structure entries of this protein is available.Can anyone please suggest as how should I choose any one/few crystal structure among them or am I supposed to dock my compounds with all the available 36 crystal structures of this protein.

Thank you

Prija Ponnan
PhD Chemistry
University of Delhi
Delhi-110007,India