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PISA Interface List.

Session Map (id=789-8I-45O)

Interfaces in PDB 4j3j crystal.
Space symmetry group: P 32. Resolution: 3.20 Å

CRYSTAL STRUCTURE OF DPP-IV WITH COMPOUND C3

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`		B	`226`	`58`	`31928`	`◊`	A	x,y,z	`1_555`	`234`	`58`	`31767`	`2173.2`	`-16.8`	`0.100`	`41`	`10`	`0`	`0.849`
2	`2`		[D3C]A:801	`28`	`1`	`643`	`f`	A	x,y,z	`1_555`	`56`	`21`	`31767`	`389.9`	`0.7`	`0.600`	`7`	`0`	`0`	`0.151`
	`3`		[D3C]B:801	`29`	`1`	`638`	`f`	B	x,y,z	`1_555`	`56`	`21`	`31928`	`380.8`	`-0.5`	`0.487`	`8`	`0`	`0`	`0.151`
	*Average:*													`385.3`	`0.1`	`0.544`	`8`	`0`	`0`	`0.151`
3	`4`		A	`40`	`13`	`31767`	`◊`	B	-y+1,x-y+1,z-1/3	`2_664`	`36`	`13`	`31928`	`350.8`	`1.9`	`0.584`	`5`	`1`	`0`	`0.000`
4	`5`		A	`18`	`5`	`31767`	`◊`	B	-y,x-y,z-1/3	`2_554`	`25`	`8`	`31928`	`174.4`	`0.4`	`0.632`	`2`	`0`	`0`	`0.000`
5	`6`		A	`12`	`3`	`31767`	`x`	A	x,y-1,z	`1_545`	`7`	`3`	`31767`	`80.9`	`-0.2`	`0.436`	`0`	`0`	`0`	`0.000`
	`7`		B	`11`	`3`	`31928`	`x`	B	x,y-1,z	`1_545`	`6`	`3`	`31928`	`80.4`	`-1.2`	`0.207`	`0`	`0`	`0`	`0.000`
	*Average:*													`80.7`	`-0.7`	`0.322`	`0`	`0`	`0`	`0.000`
6	`8`		B	`7`	`2`	`31928`	`x`	B	x-1,y,z	`1_455`	`11`	`4`	`31928`	`75.9`	`1.4`	`0.831`	`0`	`0`	`0`	`0.000`
	`9`		A	`12`	`4`	`31767`	`x`	A	x-1,y-1,z	`1_445`	`5`	`2`	`31767`	`67.3`	`1.1`	`0.806`	`0`	`0`	`0`	`0.000`
	*Average:*													`71.6`	`1.3`	`0.818`	`0`	`0`	`0`	`0.000`

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