PDBe < PISA < EMBL-EBI

PISA Interface List.

Session Map (id=155-DP-KKD)

Interfaces in PDB 4y46 crystal.
Space symmetry group: P 21 21 21. Resolution: 2.04 Å

PYRIDOPYRIMIDINONE DERIVATIVES AS POTENT AND SELECTIVE C-JUN N- TERMINAL KINASE (JNK) INHIBITORS

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	`97`	`31`	`16967`	`x`	A	-x,y-1/2,-z-1/2	`3_544`	`93`	`28`	`16967`	`881.0`	`-7.4`	`0.327`	`2`	`7`	`0`	`0.000`
`2`		[4F2]A:501	`29`	`1`	`632`	`f`	A	x,y,z	`1_555`	`47`	`18`	`16967`	`358.0`	`-2.8`	`0.599`	`1`	`0`	`0`	`0.100`
`3`		A	`29`	`8`	`16967`	`x`	A	-x+1/2,-y-1,z-1/2	`2_544`	`27`	`6`	`16967`	`269.2`	`-1.9`	`0.426`	`2`	`2`	`0`	`0.000`
`4`		A	`24`	`7`	`16967`	`x`	A	x-1/2,-y-1/2,-z	`4_445`	`28`	`9`	`16967`	`209.2`	`-0.8`	`0.579`	`1`	`0`	`0`	`0.000`
`5`		A	`10`	`5`	`16967`	`x`	A	-x+1/2,-y,z-1/2	`2_554`	`8`	`3`	`16967`	`86.5`	`1.8`	`0.883`	`0`	`5`	`0`	`0.000`
`6`		[4F2]A:501	`4`	`1`	`632`	`◊`	A	-x,y-1/2,-z-1/2	`3_544`	`6`	`3`	`16967`	`52.5`	`-0.4`	`0.561`	`0`	`0`	`0`	`0.000`
`7`		A	`1`	`1`	`16967`	`x`	A	-x+1,y-1/2,-z-1/2	`3_644`	`1`	`1`	`16967`	`1.3`	`0.0`	`0.712`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
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