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Interfaces in PDB 4npv crystal.
Space symmetry group: P 43 21 2. Resolution: 2.40 Å

CRYSTAL STRUCTURE OF HUMAN PDE1B BOUND TO INHIBITOR 7A (6,7,8- TRIMETHOXY-N-(PENTAN-3-YL)QUINAZOLIN-4-AMINE)

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`	`23`	`15317`	`◊`	A	y,x,-z+1	`6_556`	`96`	`23`	`15317`	`956.4`	`1.7`	`0.875`	`22`	`14`	`0`	`0.000`
`2`		A	`38`	`9`	`15317`	`x`	A	-y+1/2,x+1/2,z-1/4	`2_554`	`52`	`14`	`15317`	`434.7`	`-4.4`	`0.348`	`1`	`2`	`0`	`0.000`
`3`		A	`45`	`13`	`15317`	`x`	A	-x+1/2,y-1/2,-z+3/4	`7_545`	`48`	`13`	`15317`	`432.4`	`-7.4`	`0.143`	`1`	`2`	`0`	`0.000`
`4`		[0NK]A:601	`22`	`1`	`505`	`f`	A	x,y,z	`1_555`	`45`	`17`	`15317`	`343.0`	`0.7`	`0.292`	`1`	`0`	`0`	`0.000`
`5`		[MG]A:602	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`15`	`9`	`15317`	`57.5`	`-7.4`	`0.000`	`0`	`0`	`0`	`0.015`
`6`		[ZN]A:603	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`6`	`3`	`15317`	`43.3`	`-32.5`	`0.000`	`0`	`0`	`0`	`0.067`
`7`		[ZN]A:603	`1`	`1`	`98`	`f`	[MG]A:602	x,y,z	`1_555`	`1`	`1`	`98`	`12.6`	`-6.2`	`0.000`	`0`	`0`	`0`	`0.013`
`8`		[MG]A:602	`1`	`1`	`98`	`f`	[0NK]A:601	x,y,z	`1_555`	`2`	`1`	`505`	`6.8`	`-0.8`	`0.000`	`0`	`0`	`0`	`0.002`
`9`		[ZN]A:603	`1`	`1`	`98`	`f`	[0NK]A:601	x,y,z	`1_555`	`1`	`1`	`505`	`4.6`	`-1.7`	`0.000`	`0`	`0`	`0`	`0.004`

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

Protein Data Bank
in Europe