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Interfaces in PDB 3kcl crystal.
Space symmetry group: I 2 2 2. Resolution: 2.00 Å

ROOM TEMPERATURE NEUTRON STRUCTURE OF D-XYLOSE ISOMERASE IN COMPLEX WITH TWO CD2+ CATIONS AND D12-D-ALPHA-GLUCOSE IN THE RING FORM (REFINED JOINTLY WITH X-RAY STRUCTURE 3KBM)

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	`555`	`124`	`19782`	`◊`	A	x,-y,-z-1	`4_554`	`555`	`124`	`19782`	`4987.8`	`-62.1`	`0.618`	`58`	`48`	`0`	`0.697`
`2`		A	`184`	`41`	`19782`	`◊`	A	-x,y,-z-1	`3_554`	`181`	`41`	`19782`	`1569.9`	`-10.7`	`0.961`	`12`	`8`	`0`	`0.291`
`3`		A	`165`	`48`	`19782`	`◊`	A	-x,-y,z	`2_555`	`166`	`48`	`19782`	`1527.7`	`-12.4`	`0.890`	`36`	`18`	`0`	`0.429`
`4`		A	`34`	`10`	`19782`	`x`	A	-x-1/2,y-1/2,-z-1/2	`7_444`	`33`	`8`	`19782`	`266.7`	`6.3`	`1.000`	`2`	`2`	`0`	`0.000`
`5`		[GLC]A:401	`23`	`1`	`349`	`f`	A	x,y,z	`1_555`	`45`	`19`	`19782`	`203.7`	`-1.9`	`0.546`	`2`	`0`	`0`	`0.094`
`6`		[CD]A:391	`1`	`1`	`112`	`f`	A	x,y,z	`1_555`	`6`	`5`	`19782`	`44.8`	`-6.8`	`0.000`	`0`	`0`	`0`	`0.230`
`7`		[CD]A:392	`1`	`1`	`112`	`f`	A	x,y,z	`1_555`	`7`	`5`	`19782`	`37.9`	`-5.3`	`0.000`	`0`	`0`	`0`	`0.181`
`8`		[GLC]A:401	`6`	`1`	`349`	`f`	[CD]A:392	x,y,z	`1_555`	`1`	`1`	`112`	`31.4`	`-2.9`	`0.000`	`0`	`0`	`0`	`0.098`
`9`		[GLC]A:401	`4`	`1`	`349`	`◊`	A	-x,y,-z-1	`3_554`	`2`	`1`	`19782`	`26.7`	`-0.3`	`0.280`	`0`	`0`	`0`	`0.010`
`10`		[GLC]A:401	`2`	`1`	`349`	`f`	[CD]A:391	x,y,z	`1_555`	`1`	`1`	`112`	`17.8`	`-1.3`	`0.000`	`0`	`0`	`0`	`0.045`
`11`		[CD]A:392	`1`	`1`	`112`	`f`	[CD]A:391	x,y,z	`1_555`	`1`	`1`	`112`	`9.6`	`-1.5`	`0.000`	`0`	`0`	`0`	`0.052`

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

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Protein Data Bank in Europe

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PDBePISA

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