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Session Map (id=369-0D-4O1)

Interfaces in PDB 5fnm crystal.
Space symmetry group: P 1 21 1. Resolution: 1.59 Å

NATIVE STATE MASS SPECTROMETRY, SURFACE PLASMON RESONANCE AND X-RAY CRYSTALLOGRAPHY CORRELATE STRONGLY AS A FRAGMENT SCREENING COMBINATION

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	`53`	`17`	`11752`	`x`	A	x-1,y,z	`1_455`	`44`	`10`	`11752`	`430.6`	`-0.9`	`0.527`	`5`	`5`	`0`	`0.000`
`2`		A	`35`	`12`	`11752`	`x`	A	-x,y-1/2,-z+1	`2_546`	`40`	`16`	`11752`	`343.9`	`1.8`	`0.745`	`3`	`0`	`0`	`0.000`
`3`		A	`33`	`10`	`11752`	`x`	A	-x-1,y-1/2,-z	`2_445`	`32`	`11`	`11752`	`324.5`	`0.6`	`0.576`	`4`	`1`	`0`	`0.000`
`4`		A	`36`	`10`	`11752`	`x`	A	x,y-1,z	`1_545`	`30`	`10`	`11752`	`298.3`	`1.1`	`0.683`	`3`	`0`	`0`	`0.000`
`5`		A	`28`	`10`	`11752`	`x`	A	-x,y-1/2,-z	`2_545`	`38`	`15`	`11752`	`287.0`	`-1.5`	`0.298`	`2`	`1`	`0`	`0.000`
`6`		[5O6]A:1262	`14`	`1`	`377`	`f`	A	x,y,z	`1_555`	`27`	`15`	`11752`	`222.5`	`-3.8`	`0.301`	`3`	`0`	`0`	`0.012`
`7`		[ZN]A:262	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`5`	`4`	`11752`	`45.1`	`-32.9`	`0.000`	`0`	`0`	`0`	`0.075`
`8`		[5O6]A:1262	`3`	`1`	`377`	`f`	[ZN]A:262	x,y,z	`1_555`	`1`	`1`	`98`	`15.9`	`-5.8`	`0.000`	`0`	`0`	`0`	`0.013`

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

Protein Data Bank
in Europe