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Session Map (id=274-5P-A5N)

Interfaces in PDB 2q8i crystal.
Space symmetry group: P 65 2 2. Resolution: 2.60 Å

PYRUVATE DEHYDROGENASE KINASE ISOFORM 3 IN COMPLEX WITH ANTITUMOR DRUG RADICICOL

Interfaces

##		Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
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`		A	`280`	`74`	`19413`	`◊`	A	-x+y-1,y,-z+1/2	`11_455`	`281`	`75`	`19413`	`2566.9`	`-15.3`	`0.412`	`46`	`18`	`0`	`0.147`
`2`		B	`55`	`15`	`5829`	`◊`	A	x,y,z	`1_555`	`88`	`27`	`19413`	`652.5`	`-8.2`	`0.198`	`4`	`0`	`0`	`0.081`
`3`		A	`62`	`14`	`19413`	`x`	A	y-1,x,-z+2/3	`7_455`	`57`	`16`	`19413`	`581.1`	`-0.4`	`0.665`	`13`	`4`	`0`	`0.000`
`4`		B	`65`	`18`	`5829`	`◊`	A	-x+y-1,y,-z+1/2	`11_455`	`55`	`16`	`19413`	`553.3`	`2.7`	`0.716`	`11`	`5`	`0`	`0.020`
`5`		B	`44`	`13`	`5829`	`◊`	A	y-1,x,-z+2/3	`7_455`	`34`	`8`	`19413`	`388.2`	`-4.7`	`0.240`	`5`	`0`	`0`	`0.000`
`6`		[RDC]A:408	`23`	`1`	`492`	`f`	A	x,y,z	`1_555`	`47`	`15`	`19413`	`324.1`	`-6.6`	`0.435`	`3`	`0`	`0`	`0.065`
`7`		[K]A:407	`1`	`1`	`216`	`f`	A	x,y,z	`1_555`	`13`	`6`	`19413`	`116.7`	`-101.7`	`0.000`	`0`	`0`	`0`	`0.824`
`8`		[GOL]A:409	`6`	`1`	`213`	`f`	A	x,y,z	`1_555`	`20`	`8`	`19413`	`106.6`	`-0.7`	`0.498`	`1`	`0`	`0`	`0.009`
`9`		[GOL]A:409	`4`	`1`	`213`	`◊`	A	-x+y-1,y,-z+1/2	`11_455`	`5`	`2`	`19413`	`48.6`	`0.8`	`0.749`	`3`	`0`	`0`	`0.004`
`10`		[GOL]A:409	`2`	`1`	`213`	`◊`	[GOL]A:409	-x+y-1,y,-z+1/2	`11_455`	`2`	`1`	`213`	`21.8`	`0.5`	`0.750`	`1`	`0`	`0`	`0.000`
`11`		[K]A:407	`1`	`1`	`216`	`◊`	B	x,y,z	`1_555`	`1`	`1`	`5829`	`5.5`	`-2.6`	`0.000`	`0`	`0`	`0`	`0.021`

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

Protein Data Bank
in Europe