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Interfaces in PDB 6cxu crystal.
Space symmetry group: P 21 21 21. Resolution: 2.49 Å

STRUCTURE OF THE S167H MUTANT OF HUMAN INDOLEAMINE 2,3 DIOXYGENASE IN COMPLEX WITH TRYPTOPHAN AND CYANIDE

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	`75`	`25`	`16998`	`◊`	A	x,y,z	`1_555`	`74`	`24`	`16850`	`611.2`	`-0.9`	`0.552`	`7`	`0`	`1`	`0.000`
2	`2`		[HEM]B:500	`43`	`1`	`805`	`f`	B	x,y,z	`1_555`	`89`	`33`	`16998`	`597.2`	`-23.2`	`0.189`	`6`	`0`	`0`	`0.093`
	`3`		[HEM]A:500	`43`	`1`	`808`	`f`	A	x,y,z	`1_555`	`82`	`32`	`16850`	`594.7`	`-23.6`	`0.159`	`6`	`0`	`0`	`0.093`
	*Average:*													`596.0`	`-23.4`	`0.174`	`6`	`0`	`0`	`0.093`
3	`4`		A	`42`	`13`	`16850`	`◊`	B	-x+2,y-1/2,-z+5/2	`3_747`	`50`	`13`	`16998`	`453.1`	`-2.1`	`0.374`	`4`	`5`	`0`	`0.000`
4	`5`		A	`48`	`12`	`16850`	`◊`	B	x-1/2,-y+1/2,-z+2	`4_457`	`45`	`12`	`16998`	`381.4`	`2.2`	`0.770`	`10`	`2`	`0`	`0.000`
5	`6`		A	`24`	`7`	`16850`	`◊`	B	-x+3,y-1/2,-z+5/2	`3_847`	`27`	`8`	`16998`	`214.7`	`2.6`	`0.842`	`2`	`2`	`0`	`0.000`
6	`7`		B	`11`	`3`	`16998`	`x`	B	-x+2,y-1/2,-z+5/2	`3_747`	`15`	`6`	`16998`	`94.9`	`1.9`	`0.828`	`2`	`2`	`0`	`0.000`
7	`8`		[CYN]B:501	`2`	`1`	`147`	`f`	B	x,y,z	`1_555`	`12`	`6`	`16998`	`62.2`	`0.1`	`0.734`	`0`	`0`	`0`	`0.000`
8	`9`		[CYN]A:501	`2`	`1`	`148`	`f`	A	x,y,z	`1_555`	`11`	`6`	`16850`	`61.5`	`0.0`	`0.732`	`0`	`0`	`0`	`0.000`
9	`10`		[CYN]A:501	`2`	`1`	`148`	`cf`	[HEM]A:500	x,y,z	`1_555`	`19`	`1`	`808`	`50.6`	`-1.9`	`0.866`	`0`	`0`	`0`	`0.007`
10	`11`		[CYN]B:501	`2`	`1`	`147`	`cf`	[HEM]B:500	x,y,z	`1_555`	`19`	`1`	`805`	`50.4`	`-1.9`	`0.866`	`0`	`0`	`0`	`0.007`

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

Protein Data Bank
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