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Interfaces in PDB 6au0 crystal.
Space symmetry group: I 41 2 2. Resolution: 2.10 Å

CRYSTAL STRUCTURE OF PPK2 (CLASS III) IN COMPLEX WITH BISPHOSPHONATE INHIBITOR (2-((3,5-DICHLOROPHENYL)AMINO)ETHANE-1,1-DIYL)DIPHOSPHONIC ACID

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	`163`	`46`	`16377`	`◊`	A	y,x,-z	`15_444`	`162`	`46`	`16377`	`1610.6`	`-18.8`	`0.079`	`10`	`10`	`0`	`0.350`
`2`		A	`125`	`29`	`16377`	`◊`	A	-y,-x,-z	`8_555`	`123`	`29`	`16377`	`1102.2`	`-6.1`	`0.459`	`20`	`6`	`0`	`0.251`
`3`		A	`86`	`27`	`16377`	`◊`	A	-x+1/2,y,-z-1/4	`5_554`	`85`	`27`	`16377`	`814.7`	`-14.9`	`0.029`	`4`	`0`	`0`	`0.266`
`4`		[BWJ]A:401	`18`	`1`	`451`	`f`	A	x,y,z	`1_555`	`44`	`14`	`16377`	`291.6`	`-15.4`	`0.702`	`6`	`0`	`0`	`0.577`
`5`		[GOL]A:402	`6`	`1`	`221`	`f`	A	x,y,z	`1_555`	`25`	`10`	`16377`	`137.7`	`-0.8`	`0.530`	`5`	`0`	`0`	`0.095`
`6`		[GOL]A:403	`6`	`1`	`223`	`f`	A	x,y,z	`1_555`	`17`	`7`	`16377`	`118.9`	`-0.2`	`0.574`	`4`	`0`	`0`	`0.062`
`7`		[GOL]A:403	`5`	`1`	`223`	`◊`	A	-y,-x,-z	`8_555`	`7`	`2`	`16377`	`54.5`	`0.7`	`0.712`	`3`	`0`	`0`	`0.020`
`8`		A	`9`	`2`	`16377`	`◊`	A	x,-y+1/2,-z+1/4	`6_555`	`9`	`2`	`16377`	`49.6`	`-0.6`	`0.505`	`0`	`0`	`0`	`0.000`
`9`		A	`5`	`3`	`16377`	`◊`	A	-x,-y,z	`10_444`	`5`	`3`	`16377`	`32.0`	`-0.5`	`0.454`	`0`	`0`	`0`	`0.005`

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

Protein Data Bank
in Europe