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Interfaces in PDB 3f2r crystal.
Space symmetry group: P 21 21 21. Resolution: 2.35 Å

CRYSTAL STRUCTURE OF HUMAN CHOLINE KINASE ALPHA IN COMPLEX WITH HEMICHOLINIUM-3

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	`112`	`28`	`15598`	`◊`	A	x,y,z	`1_555`	`110`	`27`	`17138`	`1017.0`	`-9.9`	`0.477`	`16`	`16`	`0`	`0.529`
2	`2`		A	`43`	`11`	`17138`	`◊`	B	-x-1/2,-y,z-1/2	`2_454`	`54`	`13`	`15598`	`471.0`	`0.5`	`0.806`	`7`	`2`	`0`	`0.000`
3	`3`		A	`49`	`17`	`17138`	`◊`	B	-x,y-1/2,-z+1/2	`3_545`	`51`	`14`	`15598`	`460.0`	`-3.9`	`0.534`	`5`	`0`	`0`	`0.000`
4	`4`		[HC6]B:603	`26`	`1`	`644`	`f`	B	x,y,z	`1_555`	`64`	`17`	`15598`	`363.6`	`-8.2`	`0.757`	`1`	`0`	`0`	`0.471`
	`5`		[HC6]A:603	`26`	`1`	`644`	`f`	A	x,y,z	`1_555`	`62`	`17`	`17138`	`361.0`	`-8.2`	`0.727`	`1`	`0`	`0`	`0.471`
	*Average:*													`362.3`	`-8.2`	`0.742`	`1`	`0`	`0`	`0.471`
5	`6`		A	`25`	`10`	`17138`	`x`	A	-x-1/2,-y,z-1/2	`2_454`	`32`	`10`	`17138`	`269.8`	`-4.4`	`0.267`	`1`	`0`	`0`	`0.000`
6	`7`		B	`14`	`5`	`15598`	`x`	B	x-1,y,z	`1_455`	`21`	`6`	`15598`	`162.9`	`-1.1`	`0.601`	`1`	`0`	`0`	`0.000`
7	`8`		A	`17`	`6`	`17138`	`x`	A	x-1/2,-y-1/2,-z	`4_445`	`20`	`5`	`17138`	`155.4`	`0.4`	`0.780`	`2`	`1`	`0`	`0.000`
8	`9`		A	`13`	`6`	`17138`	`◊`	B	-x+1/2,-y,z-1/2	`2_554`	`15`	`3`	`15598`	`136.3`	`-1.5`	`0.465`	`2`	`0`	`0`	`0.000`
9	`10`		A	`6`	`1`	`17138`	`◊`	B	x-1/2,-y+1/2,-z	`4_455`	`6`	`3`	`15598`	`44.4`	`-0.1`	`0.640`	`0`	`0`	`0`	`0.000`
10	`11`		A	`5`	`1`	`17138`	`◊`	B	x-1,y,z	`1_455`	`2`	`2`	`15598`	`33.5`	`-0.3`	`0.377`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe