WaterMap of TRY-UNI-714-6

Dear All,

Similar to last round I created several WaterMaps of which I shared:
a holo WM of: “WM-Mpro-x2646_TRY-UNI-714-6”:

For TRY-UNI-714-6 I see 3 areas of improvement:

  1. Replacing HOH-6 (as in the Xray), highly unfavorable water molecule will be tricky to replace -halogen bond with Cl.
  2. Replacing HOH-94- merging with BAR-COM-4e0-39 would be an option
  3. Replacing HOH-218+265

Some ideas from my side to tackle these different objectives will be shared during the next couple of days.

1 Like