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PISA Interface List.

Session Map (id=918-C5-D29)

Interfaces in PDB 3nkk crystal.
Space symmetry group: P 21 21 21. Resolution: 1.12 Å

TRYPSIN IN COMPLEX WITH FLUORINE CONTAINING FRAGMENT

Interfaces

##		Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
NN	«»	Range	ⁱN_at	ⁱN_res	Surface Å²	×	Range	Symmetry op-n	Sym.ID	ⁱN_at	ⁱN_res	Surface Å²	interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
`1`		A	`63`	`19`	`9097`	`x`	A	x-1/2,-y+1/2,-z+1	`4_456`	`58`	`18`	`9097`	`554.6`	`-0.0`	`0.672`	`10`	`0`	`0`	`0.000`
`2`		A	`52`	`18`	`9097`	`x`	A	-x+1,y-1/2,-z+1/2	`3_645`	`55`	`19`	`9097`	`498.3`	`-1.2`	`0.560`	`6`	`0`	`0`	`0.000`
`3`		[JLZ]A:1	`11`	`1`	`313`	`f`	A	x,y,z	`1_555`	`36`	`16`	`9097`	`206.2`	`3.8`	`0.559`	`6`	`0`	`0`	`0.000`
`4`		A	`19`	`6`	`9097`	`x`	A	-x+1/2,-y+1,z-1/2	`2_564`	`17`	`10`	`9097`	`145.2`	`0.4`	`0.556`	`2`	`0`	`0`	`0.000`
`5`		[DMS]A:301	`4`	`1`	`212`	`◊`	A	x,y,z	`1_555`	`20`	`7`	`9097`	`109.4`	`2.0`	`0.474`	`0`	`0`	`0`	`0.000`
`6`		[DMS]A:305	`4`	`1`	`213`	`◊`	A	-x+1,y-1/2,-z+1/2	`3_645`	`15`	`7`	`9097`	`106.5`	`1.7`	`0.428`	`0`	`0`	`0`	`0.000`
`7`		[DMS]A:303	`4`	`1`	`212`	`f`	A	x,y,z	`1_555`	`19`	`8`	`9097`	`98.8`	`1.1`	`0.397`	`2`	`0`	`0`	`0.000`
`8`		[DMS]A:302	`4`	`1`	`214`	`◊`	A	x,y,z	`1_555`	`10`	`4`	`9097`	`85.1`	`1.1`	`0.453`	`0`	`0`	`0`	`0.000`
`9`		A	`12`	`4`	`9097`	`◊`	[DMS]A:303	x-1/2,-y+1/2,-z+1	`4_456`	`4`	`1`	`212`	`75.3`	`2.7`	`0.499`	`0`	`0`	`0`	`0.000`
`10`		[DMS]A:302	`3`	`1`	`214`	`◊`	A	x-1/2,-y+1/2,-z+1	`4_456`	`4`	`1`	`9097`	`49.5`	`0.8`	`0.202`	`0`	`0`	`0`	`0.000`
`11`		[CA]A:501	`1`	`1`	`85`	`f`	A	x,y,z	`1_555`	`7`	`5`	`9097`	`41.2`	`-11.8`	`0.000`	`0`	`0`	`0`	`0.120`
`12`		[DMS]A:305	`3`	`1`	`213`	`f`	A	x,y,z	`1_555`	`5`	`2`	`9097`	`40.3`	`1.1`	`0.381`	`0`	`0`	`0`	`0.000`
`13`		[DMS]A:305	`3`	`1`	`213`	`◊`	[DMS]A:301	x,y,z	`1_555`	`3`	`1`	`212`	`34.5`	`1.8`	`0.203`	`0`	`0`	`0`	`0.000`
`14`		[DMS]A:301	`2`	`1`	`212`	`f`	A	-x+1,y-1/2,-z+1/2	`3_645`	`3`	`2`	`9097`	`33.2`	`0.9`	`0.624`	`1`	`0`	`0`	`0.000`
`15`		[CA]A:501	`1`	`1`	`85`	`f`	[DMS]A:303	x,y,z	`1_555`	`2`	`1`	`212`	`5.7`	`-1.0`	`0.000`	`0`	`0`	`0`	`0.010`
`16`		[DMS]A:302	`1`	`1`	`214`	`f`	A	-x+1,y-1/2,-z+1/2	`3_645`	`1`	`1`	`9097`	`3.1`	`0.1`	`0.304`	`0`	`0`	`0`	`0.000`

PDBe PISA v1.52 [20/10/2014]