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PISA Interface List.

Session Map (id=339-4A-D61)

Interfaces in PDB 4uwh crystal.
Space symmetry group: P 21 21 2. Resolution: 1.93 Å

DISCOVERY OF (2S)-8-((3R)-3-METHYLMORPHOLIN-4-YL)-1-(3- METHYL-2-OXO-BUTYL)-2-(TRIFLUOROMETHYL)-3,4-DIHYDRO-2H- PYRIMIDO(1,2-A)PYRIMIDIN-6-ONE: A NOVEL POTENT AND SELECTIVE INHIBITOR OF VPS34 FOR THE TREATMENT OF SOLID TUMORS

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	`103`	`29`	`24976`	`◊`	A	-x,-y,z	`2_555`	`102`	`29`	`24976`	`988.3`	`-1.2`	`0.540`	`18`	`4`	`0`	`0.000`
`2`		A	`102`	`25`	`24976`	`x`	A	x,y,z-1	`1_554`	`104`	`30`	`24976`	`940.3`	`-3.2`	`0.408`	`11`	`4`	`0`	`0.000`
`3`		A	`78`	`19`	`24976`	`x`	A	x-1/2,-y-1/2,-z-1	`4_444`	`87`	`24`	`24976`	`794.3`	`1.1`	`0.591`	`13`	`6`	`0`	`0.000`
`4`		A	`53`	`17`	`24976`	`x`	A	x-1/2,-y-1/2,-z	`4_445`	`59`	`14`	`24976`	`518.0`	`-7.0`	`0.081`	`3`	`0`	`0`	`0.000`
`5`		[JXM]A:1876	`28`	`1`	`582`	`f`	A	x,y,z	`1_555`	`55`	`21`	`24976`	`397.5`	`-0.5`	`0.192`	`2`	`0`	`0`	`0.007`
`6`		[NA]A:1874	`1`	`1`	`125`	`f`	A	x,y,z	`1_555`	`9`	`6`	`24976`	`71.6`	`-10.5`	`0.000`	`0`	`0`	`0`	`0.056`
`7`		[NA]A:1875	`1`	`1`	`125`	`f`	A	x,y,z-1	`1_554`	`11`	`4`	`24976`	`52.8`	`-6.9`	`0.000`	`0`	`0`	`0`	`0.037`
`8`		[NA]A:1875	`1`	`1`	`125`	`◊`	A	x,y,z	`1_555`	`9`	`5`	`24976`	`50.8`	`-5.1`	`0.000`	`0`	`0`	`0`	`0.000`
`9`		A	`2`	`1`	`24976`	`x`	A	-x,-y,z-1	`2_554`	`3`	`1`	`24976`	`29.5`	`1.4`	`0.863`	`2`	`2`	`0`	`0.000`
`10`		A	`1`	`1`	`24976`	`◊`	[NA]A:1875	x-1/2,-y-1/2,-z-1	`4_444`	`1`	`1`	`125`	`0.6`	`-0.1`	`0.000`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe

Bringing Structure to Biology

PDBePISA

Protein Data Bank in Europe

Bringing Structure to Biology

PDBePISA

Protein Data Bank
in Europe