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PISA Interface List.

Session Map (id=922-93-5BJ)

Interfaces in PDB 6w3a crystal.
Space symmetry group: P 21 21 21. Resolution: 2.61 Å

STRUCTURE OF UNPHOSPHORYLATED IRE1 IN COMPLEX WITH G-7658

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	`132`	`40`	`18378`	`◊`	A	x,y,z	`1_555`	`132`	`43`	`18097`	`1271.7`	`0.8`	`0.933`	`13`	`19`	`0`	`0.000`
2	`2`		[SJM]B:1001	`36`	`1`	`757`	`f`	B	x,y,z	`1_555`	`70`	`27`	`18378`	`543.0`	`0.8`	`0.573`	`3`	`0`	`0`	`0.100`
	`3`		[SJM]A:1001	`36`	`1`	`762`	`f`	A	x,y,z	`1_555`	`75`	`26`	`18097`	`542.5`	`0.4`	`0.537`	`3`	`0`	`0`	`0.100`
	*Average:*													`542.7`	`0.6`	`0.555`	`3`	`0`	`0`	`0.100`
3	`4`		B	`37`	`13`	`18378`	`◊`	A	-x+2,y-1/2,-z+1/2	`3_745`	`34`	`9`	`18097`	`378.4`	`-8.0`	`0.089`	`0`	`0`	`0`	`0.000`
	`5`		B	`22`	`7`	`18378`	`◊`	A	-x+3,y-1/2,-z+1/2	`3_845`	`27`	`9`	`18097`	`266.2`	`-5.1`	`0.170`	`1`	`0`	`0`	`0.000`
	*Average:*													`322.3`	`-6.6`	`0.129`	`1`	`0`	`0`	`0.000`
4	`6`		A	`17`	`5`	`18097`	`◊`	B	x-1/2,-y-1/2,-z	`4_445`	`20`	`5`	`18378`	`163.6`	`-3.5`	`0.240`	`0`	`0`	`0`	`0.000`
5	`7`		A	`17`	`6`	`18097`	`◊`	B	-x+5/2,-y,z-1/2	`2_754`	`11`	`3`	`18378`	`117.0`	`0.7`	`0.799`	`0`	`1`	`0`	`0.000`
6	`8`		A	`6`	`3`	`18097`	`x`	A	-x+2,y-1/2,-z+1/2	`3_745`	`2`	`1`	`18097`	`31.6`	`-0.3`	`0.329`	`0`	`0`	`0`	`0.000`
	`9`		B	`3`	`1`	`18378`	`x`	B	-x+3,y-1/2,-z+1/2	`3_845`	`5`	`2`	`18378`	`22.2`	`-0.2`	`0.468`	`0`	`0`	`0`	`0.000`
	*Average:*													`26.9`	`-0.2`	`0.398`	`0`	`0`	`0`	`0.000`
7	`10`		A	`5`	`2`	`18097`	`x`	A	-x+5/2,-y,z-1/2	`2_754`	`2`	`2`	`18097`	`26.9`	`-0.8`	`0.267`	`0`	`0`	`0`	`0.000`
8	`11`		B	`1`	`1`	`18378`	`x`	B	x-1/2,-y-1/2,-z	`4_445`	`4`	`2`	`18378`	`17.7`	`-0.5`	`0.242`	`0`	`0`	`0`	`0.000`

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