hydrogens out of plane

Igor Mochalkin igor at msi.com
Wed Mar 28 04:41:56 EST 2001


Hi,
I am not familiar with this particular problem, but you always can try 
another programs to add hydrogens to your protein. QUANTA can do it.

Igor



At 06:12 PM 3/27/2001 +0200, Stefan Loverix wrote:
>Hi there,
>
>As a starting crystallographer, I 'm encoutering problems with adding
>hydrogens to my protein structure, using CNS... in particular,
>hydrogens on histidines (these are all charged) are often not in the
>plane of the histidine, which should be the case for an aromatic
>residue. All suggestions are highly appreciated...
>
>
>
>--
>Stefan Loverix
>Vrije Universiteit Brussel
>Instituut voor Moleculaire Biologie/Biotechnologie
>Dienst Ultrastruktuur
>Paardenstraat 65,
>B- 1640 Sint-Genesius-Rode
>Belgium
>Tel: 32/2/359 02 68
>Fax: 32/2/359 02 89
>Email: SLOVERIX at VUB.AC.BE

==========================================
Igor Mochalkin, PhD.		 igor at msi.com
Product Specialist, X-Ray	Tel:  (858) 799-5224
Molecular Simulations Inc.	Fax: (858) 458-0136
9685 Scranton Road		 URL: http://www.msi.com
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