NMR Restraints Grid

Result table
(Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype

2265 1bm6 4173 cing 1-original 3 XPLOR/CNS distance general distance simple

!distance constraints between Zinc(256,257), Calcium(258,259) and their ligands
!data from stromelysin crystal structure by BECKER et al. 1995
assign (resid  201 and name NE2  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  2.05 0.1  0.1
assign (resid  201 and name CD2  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  3.09 0.1  0.1
assign (resid  201 and name CE1  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  3.04 0.1  0.1
assign (resid  201 and name CG   and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  4.23 0.1  0.1
assign (resid  201 and name ND1  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  4.20 0.1  0.1
assign (resid  205 and name NE2  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  2.05 0.1  0.1
assign (resid  205 and name CD2  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  3.09 0.1  0.1
assign (resid  205 and name CE1  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  3.04 0.1  0.1
assign (resid  205 and name CG   and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  4.23 0.1  0.1
assign (resid  205 and name ND1  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  4.20 0.1  0.1
assign (resid  211 and name NE2  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  2.05 0.1  0.1
assign (resid  211 and name CD2  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  3.09 0.1  0.1
assign (resid  211 and name CE1  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  3.04 0.1  0.1
assign (resid  211 and name CG   and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  4.23 0.1  0.1
assign (resid  211 and name ND1  and segid SLNA)
       (resid  256 and name ZN   and segid IONS)  4.20 0.1  0.1
assign (resid  151 and name NE2  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  2.05 0.1  0.1
assign (resid  151 and name CD2  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  3.09 0.1  0.1
assign (resid  151 and name CE1  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  3.04 0.1  0.1
assign (resid  151 and name CG   and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  4.23 0.1  0.1
assign (resid  151 and name ND1  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  4.20 0.1  0.1
assign (resid  166 and name NE2  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  2.05 0.1  0.1
assign (resid  166 and name CD2  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  3.09 0.1  0.1
assign (resid  166 and name CE1  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  3.04 0.1  0.1
assign (resid  166 and name CG   and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  4.23 0.1  0.1
assign (resid  166 and name ND1  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  4.20 0.1  0.1
assign (resid  179 and name NE2  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  4.20 0.1  0.1
assign (resid  179 and name CD2  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  4.23 0.1  0.1
assign (resid  179 and name CE1  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  3.04 0.1  0.1
assign (resid  179 and name CG   and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  3.09 0.1  0.1
assign (resid  179 and name ND1  and segid SLNA)
       (resid  257 and name ZN   and segid IONS)  2.05 0.1  0.1
assign (resid  158 and name od1  and segid SLNA)
       (resid  258 and name cal  and segid IONS)  2.30 0.25 0.25
assign (resid  181 and name od2  and segid SLNA)
       (resid  258 and name cal  and segid IONS)  2.30 0.25 0.25
assign (resid  184 and name oe2  and segid SLNA)
       (resid  258 and name cal  and segid IONS)  2.30 0.25 0.25
assign (resid  159 and name o    and segid SLNA)
       (resid  258 and name cal  and segid IONS)  2.30 0.25 0.25
assign (resid  161 and name o    and segid SLNA)
       (resid  258 and name cal  and segid IONS)  2.30 0.25 0.25
assign (resid  163 and name o    and segid SLNA)
       (resid  258 and name cal  and segid IONS)  2.30 0.25 0.25
assign (resid  141 and name o    and segid SLNA)
       (resid  259 and name cal  and segid IONS)  2.30 0.25 0.25
assign (resid  173 and name o    and segid SLNA)
       (resid  259 and name cal  and segid IONS)  2.30 0.25 0.25
assign (resid  175 and name o    and segid SLNA)
       (resid  259 and name cal  and segid IONS)  2.30 0.25 0.25
assign (resid  177 and name od1  and segid SLNA)
       (resid  259 and name cal  and segid IONS)  2.30 0.25 0.25

Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Thursday, April 18, 2024 2:07:52 PM GMT (wattos1)

image	mrblock_id	pdb_id	bmrb_id	cing	stage	position	program	type	subtype	subsubtype
	2265	1bm6	4173	cing	1-original	3	XPLOR/CNS	distance	general distance	simple