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Interfaces in PDB 6f4e crystal.
Space symmetry group: P 2 21 21. Resolution: 2.40 Å

CRYSTAL STRUCTURE OF THE ZINC-FREE CATALYTIC DOMAIN OF BOTULINUM NEUROTOXIN X

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	`82`	`27`	`19859`	`x`	A	-x,y-1/2,-z+1/2	`3_545`	`73`	`19`	`19859`	`736.9`	`0.4`	`0.602`	`16`	`6`	`0`	`0.000`
`2`		A	`28`	`12`	`19859`	`x`	A	x-1,y,z	`1_455`	`22`	`11`	`19859`	`229.4`	`0.7`	`0.618`	`3`	`0`	`0`	`0.000`
`3`		A	`26`	`10`	`19859`	`x`	A	-x,-y+1/2,z-1/2	`4_554`	`29`	`11`	`19859`	`220.3`	`3.7`	`0.844`	`2`	`1`	`0`	`0.000`
`4`		A	`27`	`9`	`19859`	`◊`	A	x,-y,-z	`2_555`	`27`	`9`	`19859`	`212.1`	`-1.7`	`0.407`	`3`	`0`	`0`	`0.000`
`5`		A	`19`	`5`	`19859`	`◊`	A	x,-y+1,-z+1	`2_566`	`19`	`5`	`19859`	`172.5`	`-2.4`	`0.252`	`2`	`0`	`0`	`0.000`
`6`		[PEG]A:501	`7`	`1`	`263`	`◊`	A	x,y,z	`1_555`	`22`	`8`	`19859`	`133.3`	`2.8`	`0.330`	`2`	`0`	`0`	`0.000`
`7`		[PEG]A:501	`5`	`1`	`263`	`f`	A	-x,y-1/2,-z+1/2	`3_545`	`7`	`4`	`19859`	`45.6`	`0.9`	`0.245`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
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