PDBe < PISA < EMBL-EBI

PISA Interface List.

Session Map (id=177-D4-624)

Interfaces in PDB 4o6e crystal.
Space symmetry group: P 1 21 1. Resolution: 1.95 Å

DISCOVERY OF 5,6,7,8-TETRAHYDROPYRIDO[3,4-D]PYRIMIDINE INHIBITORS OF ERK2

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	`74`	`22`	`16759`	`x`	A	-x,y-1/2,-z	`2_545`	`72`	`20`	`16759`	`648.5`	`-3.4`	`0.441`	`5`	`2`	`0`	`0.000`
`2`		[2SH]A:401	`30`	`1`	`672`	`f`	A	x,y,z	`1_555`	`66`	`26`	`16759`	`462.9`	`-8.9`	`0.416`	`5`	`0`	`0`	`0.100`
`3`		A	`34`	`12`	`16759`	`x`	A	x,y,z-1	`1_554`	`41`	`14`	`16759`	`327.5`	`2.2`	`0.743`	`2`	`0`	`0`	`0.000`
`4`		A	`31`	`8`	`16759`	`x`	A	x-1,y,z	`1_455`	`40`	`10`	`16759`	`297.2`	`-0.5`	`0.585`	`3`	`0`	`0`	`0.000`
`5`		A	`17`	`6`	`16759`	`x`	A	x-1,y,z-1	`1_454`	`15`	`4`	`16759`	`137.5`	`-0.9`	`0.467`	`2`	`0`	`0`	`0.000`
`6`		A	`23`	`8`	`16759`	`x`	A	-x+1,y-1/2,-z	`2_645`	`14`	`4`	`16759`	`120.4`	`0.7`	`0.708`	`1`	`0`	`0`	`0.000`
`7`		A	`13`	`5`	`16759`	`x`	A	-x,y-1/2,-z+1	`2_546`	`15`	`6`	`16759`	`109.9`	`-1.4`	`0.363`	`0`	`0`	`0`	`0.000`
`8`		A	`14`	`6`	`16759`	`x`	A	-x+1,y-1/2,-z+1	`2_646`	`9`	`4`	`16759`	`97.6`	`0.0`	`0.303`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe