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Interfaces in PDB 4wfj crystal.
Space symmetry group: P 21 21 21. Resolution: 1.75 Å

CRYSTAL STRUCTURE OF PET-DEGRADING CUTINASE CUT190 S226P MUTANT IN CA(2+)-BOUND STATE AT 1.75 ANGSTROM RESOLUTION

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	`63`	`18`	`10468`	`x`	A	x-1/2,-y-1/2,-z	`4_445`	`61`	`17`	`10468`	`522.8`	`-0.9`	`0.549`	`7`	`5`	`0`	`0.000`
`2`		A	`50`	`15`	`10468`	`x`	A	-x+3/2,-y,z-1/2	`2_654`	`55`	`19`	`10468`	`507.3`	`-1.6`	`0.483`	`7`	`1`	`0`	`0.000`
`3`		A	`39`	`15`	`10468`	`x`	A	x-1/2,-y+1/2,-z	`4_455`	`34`	`11`	`10468`	`328.3`	`-0.3`	`0.483`	`4`	`4`	`0`	`0.000`
`4`		[CL]A:402	`1`	`1`	`125`	`f`	A	x,y,z	`1_555`	`8`	`6`	`10468`	`55.5`	`-9.3`	`0.000`	`0`	`0`	`0`	`0.050`
`5`		[CA]A:401	`1`	`1`	`85`	`f`	A	x,y,z	`1_555`	`8`	`7`	`10468`	`44.0`	`-9.5`	`0.000`	`0`	`0`	`0`	`0.050`
`6`		A	`2`	`1`	`10468`	`◊`	[CL]A:402	x-1/2,-y+1/2,-z	`4_455`	`1`	`1`	`125`	`29.0`	`-3.6`	`0.000`	`0`	`0`	`0`	`0.000`
`7`		A	`4`	`2`	`10468`	`x`	A	-x+1,y-1/2,-z+1/2	`3_645`	`4`	`2`	`10468`	`27.2`	`0.6`	`0.781`	`0`	`0`	`0`	`0.000`
`8`		A	`6`	`3`	`10468`	`◊`	[CA]A:401	x-1/2,-y-1/2,-z	`4_445`	`1`	`1`	`85`	`19.8`	`-2.8`	`0.000`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
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