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Interfaces in PDB 1yqj crystal.
Space symmetry group: P 21 21 21. Resolution: 2.00 Å

CRYSTAL STRUCTURE OF P38 ALPHA IN COMPLEX WITH A SELECTIVE PYRIDAZINE INHIBITOR

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	`96`	`23`	`18281`	`x`	A	x-1,y,z	`1_455`	`108`	`29`	`18281`	`931.8`	`-12.6`	`0.111`	`7`	`2`	`0`	`0.000`
`2`		A	`63`	`17`	`18281`	`x`	A	-x+1,y-1/2,-z+1/2	`3_645`	`68`	`18`	`18281`	`587.8`	`-4.7`	`0.348`	`7`	`2`	`0`	`0.000`
`3`		[6NP]A:362	`34`	`1`	`672`	`f`	A	x,y,z	`1_555`	`66`	`26`	`18281`	`490.8`	`2.5`	`0.473`	`1`	`0`	`0`	`0.000`
`4`		A	`41`	`13`	`18281`	`x`	A	x-1/2,-y+1/2,-z	`4_455`	`34`	`12`	`18281`	`382.4`	`-1.2`	`0.565`	`5`	`0`	`0`	`0.000`
`5`		[SO4]A:361	`5`	`1`	`204`	`f`	A	x,y,z	`1_555`	`14`	`6`	`18281`	`101.1`	`-13.4`	`0.848`	`3`	`0`	`0`	`0.116`
`6`		A	`8`	`6`	`18281`	`◊`	[SO4]A:361	x-1,y,z	`1_455`	`5`	`1`	`204`	`70.1`	`-8.9`	`0.881`	`0`	`0`	`0`	`0.000`
`7`		A	`1`	`1`	`18281`	`x`	A	-x,y-1/2,-z+1/2	`3_545`	`2`	`1`	`18281`	`10.1`	`-0.3`	`0.274`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
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