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Session Map (id=792-HM-263)

Interfaces in PDB 5uoy crystal.
Space symmetry group: P 43 21 2. Resolution: 1.82 Å

CRYSTAL STRUCTURE OF HUMAN PDE1B CATALYTIC DOMAIN IN COMPLEX WITH INHIBITOR 16J (6-(4-METHOXYBENZYL)-9-((TETRAHYDRO-2H-PYRAN-4-YL) METHYL)-8,9,10,11-TETRAHYDROPYRIDO[4',3':4,5]THIENO[3,2-E][1,2, 4]TRIAZOLO[1,5-C]PYRIMIDIN-5(6H)-ONE)

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	`95`	`24`	`14951`	`◊`	A	y,x,-z	`7_555`	`92`	`24`	`14951`	`974.2`	`4.7`	`0.937`	`20`	`16`	`0`	`0.000`
`2`		A	`59`	`18`	`14951`	`x`	A	-x-1/2,y-1/2,-z-1/4	`5_444`	`55`	`17`	`14951`	`519.0`	`-5.6`	`0.287`	`5`	`4`	`0`	`0.000`
`3`		[8HM]A:603	`33`	`1`	`665`	`f`	A	x,y,z	`1_555`	`62`	`21`	`14951`	`452.6`	`-9.2`	`0.177`	`1`	`0`	`0`	`0.015`
`4`		A	`35`	`10`	`14951`	`x`	A	-y-1/2,x+1/2,z-1/4	`3_454`	`53`	`15`	`14951`	`427.3`	`-2.7`	`0.492`	`3`	`2`	`0`	`0.000`
`5`		[8HM]A:604	`31`	`1`	`661`	`f`	A	x,y,z	`1_555`	`50`	`9`	`14951`	`329.0`	`-6.2`	`0.337`	`1`	`0`	`0`	`0.010`
`6`		A	`17`	`6`	`14951`	`◊`	[8HM]A:604	-x-1/2,y-1/2,-z-1/4	`5_444`	`12`	`1`	`661`	`124.2`	`-3.8`	`0.259`	`0`	`0`	`0`	`0.000`
`7`		[8HM]A:603	`8`	`1`	`665`	`◊`	[8HM]A:604	-x-1/2,y-1/2,-z-1/4	`5_444`	`8`	`1`	`661`	`62.6`	`-1.3`	`0.626`	`0`	`0`	`0`	`0.000`
`8`		[MG]A:602	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`16`	`8`	`14951`	`59.7`	`-8.6`	`0.000`	`0`	`0`	`0`	`0.013`
`9`		[ZN]A:601	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`7`	`4`	`14951`	`46.1`	`-33.3`	`0.000`	`0`	`0`	`0`	`0.051`
`10`		[MG]A:602	`1`	`1`	`98`	`f`	[ZN]A:601	x,y,z	`1_555`	`1`	`1`	`98`	`14.7`	`-7.1`	`0.000`	`0`	`0`	`0`	`0.011`

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

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PDBePISA

Protein Data Bank in Europe

Bringing Structure to Biology

PDBePISA

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