We just discovered this bug here in York too.

It is fixed inthe latest pre-release - Garib is away, but I wonder if it is because in the $CLIBD/monomers/n NAG-b-D is named NAG-B-D ie the B is upper case


Try renaming it and see if that is a fix.

Eleanor


Kurt Whizler wrote:

*** For details on how to be removed from this list visit the ***
*** CCP4 home page http://www.ccp4.ac.uk ***


I am trying to connect two sugars by glycosidic bond with the following in the coordinate file:

MODRES GAL A 2 GAL-b-D RENAME
MODRES NAG A 3 NAG-b-D RENAME
LINK NAG A 3 GAL A 2 BETA1-3

Get an error message:

I am reading library. Please wait.
mon_lib.cif
WARNING : link:BETA1-3 is found dist = 1.698 ideal_dist= 1.439
ch:AA res: 2 GAL at:C1 .->Aa res: 3 NAG at:O3 .
ERROR: wrong tree structure .....
IERR = 1

I tried all possible combination for geometric restraints for sugar:

define as in file or by distance with the same result.

Can anybody tell what is wrong?

_________________________________________________________________
FREE pop-up blocking with the new MSN Toolbar – get it now! http://toolbar.msn.click-url.com/go/onm00200415ave/direct/01/




begin:vcard
fn:Eleanor  Dodson
n:Dodson;Eleanor 
email;internet:[EMAIL PROTECTED]
tel;work:+44 (0) 1904 328259
tel;fax:+44 (0) 1904 328266
tel;home:+44 (0) 1904 424449
version:2.1
end:vcard

Reply via email to