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Interfaces in PDB 2zvj crystal.
Space symmetry group: P 32 2 1. Resolution: 2.30 Å

CRYSTAL STRUCTURES OF RAT CATECHOL-O-METHYLTRANSFERASE COMPLEXED WITH COUMARINE-BASED INHIBITOR

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	`66`	`15`	`8800`	`x`	A	-x-1,-x+y-1,-z-1/3	`6_444`	`63`	`16`	`8800`	`543.1`	`-7.3`	`0.158`	`1`	`0`	`0`	`0.000`
`2`		A	`52`	`15`	`8800`	`x`	A	y-1,x,-z	`4_455`	`49`	`11`	`8800`	`440.9`	`-1.9`	`0.557`	`4`	`2`	`0`	`0.000`
`3`		[KOM]A:302	`18`	`1`	`420`	`f`	A	x,y,z	`1_555`	`27`	`12`	`8800`	`220.4`	`2.2`	`0.156`	`8`	`0`	`0`	`0.012`
`4`		A	`11`	`4`	`8800`	`◊`	A	-x,-x+y,-z-1/3	`6_554`	`11`	`4`	`8800`	`98.9`	`-1.9`	`0.231`	`0`	`0`	`0`	`0.000`
`5`		A	`4`	`2`	`8800`	`x`	A	x-1,y-1,z	`1_445`	`6`	`3`	`8800`	`45.0`	`1.9`	`0.918`	`0`	`0`	`0`	`0.000`
`6`		[MG]A:300	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`10`	`7`	`8800`	`35.9`	`-6.5`	`0.000`	`0`	`0`	`0`	`0.060`
`7`		[KOM]A:302	`4`	`1`	`420`	`f`	[MG]A:300	x,y,z	`1_555`	`1`	`1`	`98`	`31.7`	`-3.0`	`0.000`	`0`	`0`	`0`	`0.028`

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

Protein Data Bank
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