PDBe < PISA < EMBL-EBI

PISA Interface List.

Session Map (id=211-7B-LGB)

Interfaces in PDB 5wrz crystal.
Space symmetry group: P 21 21 21. Resolution: 2.20 Å

STRUCTURE OF HUMAN PARP1 CATALYTIC DOMAIN BOUND TO A PHTHALAZINONE INHIBITOR

Interfaces

##			Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
Id	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	`1`		B	`92`	`31`	`16652`	`◊`	A	x,y,z	`1_555`	`97`	`35`	`16864`	`858.8`	`-2.1`	`0.553`	`8`	`0`	`0`	`0.000`
2	`2`		A	`87`	`22`	`16864`	`◊`	B	x-1,y,z	`1_455`	`80`	`23`	`16652`	`812.1`	`-2.5`	`0.502`	`8`	`2`	`0`	`0.000`
3	`3`		A	`82`	`21`	`16864`	`◊`	B	x-1/2,-y-1/2,-z	`4_445`	`75`	`17`	`16652`	`767.7`	`-6.9`	`0.183`	`5`	`0`	`0`	`0.000`
4	`4`		A	`53`	`16`	`16864`	`x`	A	x-1,y,z	`1_455`	`58`	`19`	`16864`	`534.5`	`2.2`	`0.715`	`8`	`3`	`0`	`0.000`
	`5`		B	`55`	`20`	`16652`	`x`	B	x-1,y,z	`1_455`	`42`	`13`	`16652`	`449.2`	`2.1`	`0.759`	`9`	`3`	`0`	`0.000`
	*Average:*													`491.9`	`2.1`	`0.737`	`9`	`3`	`0`	`0.000`
5	`6`		B	`42`	`16`	`16652`	`◊`	A	-x,y-1/2,-z+1/2	`3_545`	`41`	`12`	`16864`	`356.5`	`-4.1`	`0.214`	`1`	`0`	`0`	`0.000`
6	`7`		A	`33`	`9`	`16864`	`x`	A	x-1/2,-y-1/2,-z	`4_445`	`39`	`11`	`16864`	`321.7`	`-3.8`	`0.221`	`4`	`0`	`0`	`0.000`
7	`8`		[7U3]A:1101	`18`	`1`	`426`	`f`	A	x,y,z	`1_555`	`49`	`14`	`16864`	`293.6`	`-3.1`	`0.435`	`3`	`0`	`0`	`0.100`
	`9`		[7U3]B:1101	`18`	`1`	`422`	`f`	B	x,y,z	`1_555`	`47`	`13`	`16652`	`288.8`	`-3.6`	`0.404`	`3`	`0`	`0`	`0.100`
	*Average:*													`291.2`	`-3.3`	`0.419`	`3`	`0`	`0`	`0.100`
8	`10`		B	`28`	`8`	`16652`	`x`	B	-x,y-1/2,-z+1/2	`3_545`	`29`	`8`	`16652`	`261.0`	`-1.2`	`0.481`	`3`	`0`	`0`	`0.000`
9	`11`		A	`12`	`5`	`16864`	`◊`	B	-x-1/2,-y,z-1/2	`2_454`	`8`	`3`	`16652`	`90.2`	`-0.3`	`0.438`	`1`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe