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PISA Interface List.

Session Map (id=839-E1-246)

Interfaces in PDB 1i1e crystal.
Space symmetry group: P 1 21 1. Resolution: 2.50 Å

CRYSTAL STRUCTURE OF CLOSTRIDIUM BOTULINUM NEUROTOXIN B COMPLEXED WITH DOXORUBICIN

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	`106`	`26`	`54071`	`x`	A	-x+1,y-1/2,-z+1	`2_646`	`92`	`27`	`54071`	`919.4`	`3.4`	`0.775`	`17`	`4`	`0`	`0.000`
`2`		A	`68`	`22`	`54071`	`x`	A	x,y,z-1	`1_554`	`62`	`22`	`54071`	`553.9`	`2.9`	`0.644`	`7`	`1`	`0`	`0.000`
`3`		A	`64`	`18`	`54071`	`x`	A	-x+1,y-1/2,-z	`2_645`	`60`	`20`	`54071`	`544.0`	`0.1`	`0.597`	`11`	`7`	`0`	`0.000`
`4`		[DM2]A:3001	`32`	`1`	`721`	`f`	A	x,y,z	`1_555`	`48`	`12`	`54071`	`329.4`	`-3.4`	`0.155`	`7`	`0`	`0`	`0.011`
`5`		A	`35`	`8`	`54071`	`x`	A	-x,y-1/2,-z-1	`2_544`	`38`	`14`	`54071`	`321.9`	`1.5`	`0.704`	`5`	`2`	`0`	`0.000`
`6`		A	`31`	`10`	`54071`	`x`	A	x-1,y,z-1	`1_454`	`40`	`15`	`54071`	`290.3`	`0.4`	`0.623`	`2`	`2`	`0`	`0.000`
`7`		[DM2]A:3001	`16`	`1`	`721`	`◊`	A	-x+1,y-1/2,-z	`2_645`	`35`	`10`	`54071`	`236.6`	`3.4`	`0.454`	`2`	`0`	`0`	`0.000`
`8`		A	`25`	`8`	`54071`	`x`	A	-x,y-1/2,-z	`2_545`	`22`	`7`	`54071`	`215.4`	`-0.7`	`0.402`	`2`	`0`	`0`	`0.000`
`9`		[SO4]A:1292	`5`	`1`	`186`	`f`	A	x,y,z	`1_555`	`15`	`7`	`54071`	`89.9`	`-12.2`	`0.873`	`2`	`0`	`0`	`0.021`
`10`		[ZN]A:1291	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`8`	`4`	`54071`	`38.3`	`-25.9`	`0.000`	`0`	`0`	`0`	`0.042`
`11`		[SO4]A:1292	`4`	`1`	`186`	`f`	[ZN]A:1291	x,y,z	`1_555`	`1`	`1`	`98`	`29.7`	`-15.9`	`0.000`	`0`	`0`	`0`	`0.026`

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

Protein Data Bank
in Europe