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PISA Interface List.

Session Map (id=445-52-544)

Interfaces in PDB 6qw9 crystal.
Space symmetry group: P 21 21 2. Resolution: 1.04 Å

CRYSTAL STRUCTURE OF KPC-2 COMPLEXED WITH RELEBACTAM (16 HOUR SOAK)

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	`45`	`16`	`10796`	`x`	A	x-1/2,-y+1/2,-z+1	`4_456`	`42`	`13`	`10796`	`413.4`	`-3.6`	`0.343`	`1`	`1`	`0`	`0.000`
`2`		A	`43`	`12`	`10796`	`x`	A	x-1/2,-y+1/2,-z	`4_455`	`29`	`8`	`10796`	`328.0`	`-1.0`	`0.571`	`3`	`0`	`0`	`0.000`
`3`		A	`30`	`8`	`10796`	`◊`	A	-x,-y,z	`2_555`	`30`	`8`	`10796`	`280.6`	`-2.4`	`0.397`	`1`	`0`	`0`	`0.000`
`4`		[MK7]A:305	`22`	`1`	`501`	`cf`	A	x,y,z	`1_555`	`48`	`16`	`10796`	`235.0`	`-0.2`	`0.374`	`4`	`0`	`0`	`0.005`
`5`		[JJT]A:306	`17`	`1`	`417`	`cf`	A	x,y,z	`1_555`	`41`	`14`	`10796`	`184.7`	`-2.3`	`0.538`	`3`	`0`	`0`	`0.009`
`6`		A	`16`	`7`	`10796`	`x`	A	x,y,z-1	`1_554`	`19`	`5`	`10796`	`180.1`	`0.1`	`0.297`	`0`	`0`	`0`	`0.000`
`7`		[JJT]A:306	`17`	`1`	`417`	`f`	[MK7]A:305	x,y,z	`1_555`	`17`	`1`	`501`	`140.5`	`3.1`	`0.718`	`0`	`0`	`0`	`0.000`
`8`		[GOL]A:304	`6`	`1`	`221`	`f`	A	x,y,z	`1_555`	`18`	`8`	`10796`	`117.8`	`0.8`	`0.712`	`2`	`0`	`0`	`0.000`
`9`		A	`13`	`5`	`10796`	`x`	A	-x+1/2,y-1/2,-z+1	`3_546`	`12`	`6`	`10796`	`108.8`	`-0.9`	`0.449`	`0`	`0`	`0`	`0.000`
`10`		[SO4]A:302	`5`	`1`	`186`	`f`	A	x,y,z	`1_555`	`13`	`4`	`10796`	`71.4`	`-10.5`	`0.771`	`3`	`0`	`0`	`0.028`
`11`		[SO4]A:303	`5`	`1`	`184`	`f`	A	x,y,z	`1_555`	`16`	`7`	`10796`	`56.9`	`-9.2`	`0.734`	`0`	`0`	`0`	`0.022`
`12`		[MK7]A:305	`9`	`1`	`501`	`f`	[SO4]A:303	x,y,z	`1_555`	`5`	`1`	`184`	`54.3`	`-8.7`	`0.364`	`0`	`0`	`0`	`0.020`
`13`		[SO4]A:301	`3`	`1`	`187`	`f`	A	x,y,z	`1_555`	`7`	`3`	`10796`	`45.0`	`-6.0`	`0.670`	`1`	`0`	`0`	`0.015`
`14`		A	`4`	`2`	`10796`	`◊`	[SO4]A:301	x-1/2,-y+1/2,-z	`4_455`	`4`	`1`	`187`	`43.8`	`-3.8`	`0.975`	`2`	`0`	`0`	`0.000`
`15`		[JJT]A:306	`7`	`1`	`417`	`f`	[SO4]A:303	x,y,z	`1_555`	`5`	`1`	`184`	`33.0`	`-3.9`	`0.880`	`0`	`0`	`0`	`0.009`
`16`		[MK7]A:305	`3`	`1`	`501`	`◊`	A	-x+1/2,y-1/2,-z+1	`3_546`	`1`	`1`	`10796`	`28.0`	`0.1`	`0.146`	`0`	`0`	`0`	`0.000`
`17`		A	`3`	`2`	`10796`	`x`	A	-x+1/2,y-1/2,-z	`3_545`	`5`	`4`	`10796`	`25.7`	`0.9`	`0.866`	`0`	`0`	`0`	`0.000`
`18`		[JJT]A:306	`3`	`1`	`417`	`◊`	A	-x+1/2,y-1/2,-z+1	`3_546`	`2`	`1`	`10796`	`25.2`	`-0.6`	`0.287`	`0`	`0`	`0`	`0.000`

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