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PISA Interface List.

Session Map (id=549-05-GOP)

Interfaces in PDB 1rhr crystal.
Space symmetry group: P 21 21 2. Resolution: 3.00 Å

CRYSTAL STRUCTURE OF THE COMPLEX OF CASPASE-3 WITH A CINNAMIC ACID METHYL ESTER INHIBITOR

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`		B	`220`	`53`	`6746`	`◊`	A	x,y,z	`1_555`	`212`	`55`	`8450`	`2018.0`	`-26.2`	`0.179`	`30`	`1`	`0`	`0.760`
`2`		B	`133`	`35`	`6746`	`◊`	B	-x+2,-y,z	`2_755`	`133`	`35`	`6746`	`1290.3`	`-19.3`	`0.304`	`10`	`2`	`0`	`1.000`
`3`		[CNE]A:501	`35`	`1`	`940`	`◊`	B	x,y,z	`1_555`	`58`	`14`	`6746`	`396.8`	`-3.4`	`0.569`	`6`	`0`	`0`	`0.116`
`4`		B	`34`	`9`	`6746`	`◊`	A	-x+2,-y,z	`2_755`	`35`	`10`	`8450`	`336.2`	`0.4`	`0.783`	`6`	`0`	`0`	`0.033`
`5`		[CNE]A:501	`23`	`1`	`940`	`cf`	A	x,y,z	`1_555`	`33`	`14`	`8450`	`259.5`	`-4.7`	`0.213`	`4`	`0`	`0`	`0.124`
`6`		A	`23`	`8`	`8450`	`◊`	A	-x+2,-y,z	`2_755`	`23`	`8`	`8450`	`214.4`	`-5.1`	`0.110`	`0`	`0`	`0`	`0.037`
`7`		A	`8`	`4`	`8450`	`◊`	B	x,y,z-1	`1_554`	`8`	`2`	`6746`	`75.2`	`-0.8`	`0.484`	`0`	`1`	`0`	`0.000`
`8`		[CNE]A:501	`2`	`1`	`940`	`◊`	B	x,y,z-1	`1_554`	`3`	`1`	`6746`	`17.3`	`1.0`	`0.807`	`0`	`0`	`0`	`0.000`
`9`		A	`2`	`1`	`8450`	`x`	A	x,y,z-1	`1_554`	`1`	`1`	`8450`	`8.0`	`0.1`	`0.707`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe