PDBe < PISA < EMBL-EBI

PISA Interface List.

Session Map (id=561-CM-L36)

Interfaces in PDB 3vc4 crystal.
Space symmetry group: P 65. Resolution: 2.23 Å

EXPLOITATION OF HYDROGEN BONDING CONSTRAINTS AND FLAT HYDROPHOBIC ENERGY LANDSCAPES IN PIM-1 KINASE NEEDLE SCREENING AND INHIBITOR DESIGN

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	`63`	`14`	`13298`	`x`	A	-y,x-y-1,z-1/3	`3_544`	`72`	`22`	`13298`	`650.9`	`-0.4`	`0.560`	`7`	`5`	`0`	`0.000`
`2`		A	`42`	`13`	`13298`	`x`	A	x-y,x,z-1/6	`2_554`	`35`	`9`	`13298`	`329.5`	`-1.0`	`0.456`	`7`	`2`	`0`	`0.000`
`3`		[0FS]A:1	`18`	`1`	`417`	`f`	A	x,y,z	`1_555`	`46`	`19`	`13298`	`277.9`	`-2.4`	`0.272`	`2`	`0`	`0`	`0.000`
`4`		[IMD]A:1001	`5`	`1`	`198`	`f`	A	x,y,z	`1_555`	`16`	`8`	`13298`	`119.7`	`3.6`	`0.355`	`2`	`0`	`0`	`0.000`
`5`		[IMD]A:327	`5`	`1`	`199`	`f`	A	x,y,z	`1_555`	`22`	`9`	`13298`	`113.7`	`2.8`	`0.304`	`1`	`0`	`0`	`0.000`
`6`		[0FS]A:1	`7`	`1`	`417`	`f`	[IMD]A:327	x,y,z	`1_555`	`4`	`1`	`199`	`54.4`	`1.0`	`0.169`	`0`	`0`	`0`	`0.000`
`7`		A	`1`	`1`	`13298`	`x`	A	x-y,x-1,z-1/6	`2_544`	`1`	`1`	`13298`	`2.6`	`-0.0`	`0.553`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
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