Hello.

Here is my script (for MODELLER6v2):

INCLUDE

SET ATOM_FILES_DIRECTORY=''

SET ALNFILE='GPR43_ES_HSA#2.ali'

SET KNOWNS='rhodo_1u19'

SET SEQUENCE='GPR43_ES_HSA'

SET OUTPUT_CONTROL=1 1 1 1 1      

SET STARTING_MODEL=1

SET ENDING_MODEL=1

CALL ROUTINE='model'

#Redefine the special_restraints routine to disable energy optimization on the residues 123 to 143

SUBROUTINE ROUTINE='special_restraints'

      DELETE_RESTRAINT RESIDUE_IDS='123’ ‘124'

END_SUBROUTINE

#energy optimization

ENERGY OUTPUT='SHORT'

OPTIMIZE OPTIMIZATION_METHOD=1,MAX_ITERATIONS=10

But I when I run the script, here is the error message :

No “:” in ATOM:RESID[CHAINID] atom identifier

 I have replaced several times the string after ‘RESIDUE_IDS=’ ( for example: ‘123 :’,’124 :’ ), but it doesn’t change anything.

Thanks by advance.

Ludovic PETAIN

EUROSCREEN SA

Tel +32 71 348 500

Fax +32 71 348 519

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http://www.euroscreen.com

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