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PISA Interface List.

Session Map (id=262-03-0AK)

Interfaces in PDB 6g9j crystal.
Space symmetry group: P 1 21 1. Resolution: 1.98 Å

FRAGMENT-BASED DISCOVERY OF A HIGHLY POTENT, ORALLY BIOAVAILABLE INHIBITOR WHICH MODULATES THE PHOSPHORYLATION AND CATALYTIC ACTIVITY OF ERK1/2

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	`62`	`19`	`16881`	`x`	A	x-1,y,z-1	`1_454`	`66`	`20`	`16881`	`632.5`	`-3.4`	`0.327`	`6`	`0`	`0`	`0.000`
`2`		[ERK]A:403	`36`	`1`	`773`	`f`	A	x,y,z	`1_555`	`78`	`24`	`16881`	`572.5`	`-9.4`	`0.353`	`3`	`0`	`0`	`0.028`
`3`		A	`52`	`14`	`16881`	`x`	A	x-1,y,z	`1_455`	`58`	`17`	`16881`	`519.4`	`-2.4`	`0.477`	`4`	`0`	`0`	`0.000`
`4`		A	`43`	`11`	`16881`	`x`	A	-x,y-1/2,-z+1	`2_546`	`43`	`15`	`16881`	`425.6`	`-6.0`	`0.125`	`2`	`3`	`0`	`0.000`
`5`		A	`16`	`5`	`16881`	`x`	A	-x+1,y-1/2,-z+2	`2_647`	`14`	`7`	`16881`	`155.1`	`-2.4`	`0.130`	`0`	`0`	`0`	`0.000`
`6`		A	`15`	`6`	`16881`	`x`	A	x,y,z-1	`1_554`	`13`	`5`	`16881`	`119.1`	`0.2`	`0.652`	`0`	`0`	`0`	`0.000`
`7`		[SO4]A:401	`5`	`1`	`186`	`f`	A	x,y,z	`1_555`	`12`	`6`	`16881`	`97.7`	`-13.7`	`0.916`	`4`	`0`	`0`	`0.040`
`8`		[SO4]A:402	`5`	`1`	`187`	`f`	A	x,y,z	`1_555`	`12`	`5`	`16881`	`81.3`	`-11.4`	`0.756`	`3`	`0`	`0`	`0.033`
`9`		A	`5`	`2`	`16881`	`x`	A	-x+1,y-1/2,-z+1	`2_646`	`6`	`2`	`16881`	`28.8`	`0.4`	`0.728`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe