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PISA Interface List.

Session Map (id=981-03-146)

Interfaces in PDB 4nwn crystal.
Space symmetry group: P 31 2 1. Resolution: 4.50 Å

COMPUTATIONALLY DESIGNED TWO-COMPONENT SELF-ASSEMBLING TETRAHEDRAL CAGE T32-28

Interfaces

##			Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
Id	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	`1`		H	`98`	`35`	`9432`	`◊`	B	x,y,z	`1_555`	`95`	`34`	`9268`	`1008.6`	`-14.2`	`0.973`	`14`	`0`	`0`	`1.000`
	`2`		X	`98`	`34`	`9388`	`◊`	R	x,y,z	`1_555`	`96`	`34`	`9399`	`1007.8`	`-14.1`	`0.976`	`14`	`0`	`0`	`1.000`
	`3`		N	`96`	`34`	`9342`	`◊`	D	x,y,z	`1_555`	`96`	`35`	`9419`	`1005.4`	`-14.4`	`0.969`	`14`	`0`	`0`	`1.000`
	`4`		V	`96`	`34`	`9377`	`◊`	L	x,y,z	`1_555`	`97`	`34`	`9362`	`1004.4`	`-14.2`	`0.974`	`14`	`0`	`0`	`1.000`
	`5`		T	`98`	`34`	`9300`	`◊`	F	x,y,z	`1_555`	`98`	`34`	`9377`	`995.7`	`-14.0`	`0.979`	`14`	`0`	`0`	`1.000`
	*Average:*													`1004.4`	`-14.2`	`0.974`	`14`	`0`	`0`	`1.000`
2	`6`		B	`14`	`7`	`9268`	`◊`	R	-x+1,-x+y,-z+1/3	`5_655`	`13`	`7`	`9399`	`126.3`	`-2.3`	`0.674`	`0`	`0`	`0`	`0.000`
	`7`		L	`12`	`7`	`9362`	`◊`	N	y,x-1,-z	`4_545`	`13`	`7`	`9342`	`105.1`	`-1.8`	`0.704`	`0`	`0`	`0`	`0.000`
	*Average:*													`115.7`	`-2.1`	`0.689`	`0`	`0`	`0`	`0.000`
3	`8`		J	`4`	`2`	`9342`	`◊`	J	x-y,-y,-z-1/3	`6_554`	`4`	`2`	`9342`	`48.9`	`-1.3`	`0.398`	`0`	`0`	`0`	`0.000`
4	`9`		H	`2`	`1`	`9432`	`◊`	N	-x+1,-x+y,-z+1/3	`5_655`	`3`	`1`	`9342`	`31.1`	`-0.9`	`0.363`	`0`	`0`	`0`	`0.000`

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