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Session Map (id=694-91-5B6)

Interfaces in PDB 3i03 crystal.
Space symmetry group: C 2 2 21. Resolution: 1.48 Å

CRYSTAL STRUCTURE OF BOTHROPSTOXIN-I CHEMICALLY MODIFIED BY P- BROMOPHENACYL BROMIDE (BPB) - MONOMERIC FORM AT A HIGH RESOLUTION

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	`68`	`16`	`6970`	`◊`	A	x,-y,-z+1	`4_556`	`68`	`16`	`6970`	`688.6`	`-15.8`	`0.026`	`1`	`0`	`0`	`0.000`
`2`		A	`49`	`14`	`6970`	`◊`	A	-x+1,y,-z+1/2	`3_655`	`49`	`14`	`6970`	`392.1`	`-0.7`	`0.695`	`8`	`4`	`0`	`0.000`
`3`		[PBP]A:201	`10`	`1`	`306`	`cf`	A	x,y,z	`1_555`	`29`	`16`	`6970`	`193.1`	`-3.7`	`0.498`	`0`	`0`	`0`	`0.101`
`4`		A	`25`	`7`	`6970`	`x`	A	-x+1/2,-y+1/2,z-1/2	`6_554`	`15`	`5`	`6970`	`185.3`	`-1.6`	`0.500`	`0`	`0`	`0`	`0.000`
`5`		[IPA]A:211	`4`	`1`	`198`	`◊`	A	x,y,z	`1_555`	`22`	`9`	`6970`	`112.3`	`2.8`	`0.391`	`0`	`0`	`0`	`0.000`
`6`		A	`15`	`5`	`6970`	`◊`	A	-x+1,y,-z+3/2	`3_656`	`15`	`5`	`6970`	`99.4`	`-1.0`	`0.530`	`0`	`0`	`0`	`0.000`
`7`		A	`7`	`2`	`6970`	`x`	A	x-1/2,-y+1/2,-z+1	`8_456`	`5`	`2`	`6970`	`51.1`	`-1.0`	`0.364`	`0`	`0`	`0`	`0.000`
`8`		A	`6`	`3`	`6970`	`◊`	A	-x,y,-z+1/2	`3_555`	`6`	`3`	`6970`	`40.3`	`-1.2`	`0.343`	`0`	`0`	`0`	`0.000`
`9`		[IPA]A:211	`3`	`1`	`198`	`◊`	[PBP]A:201	x,y,z	`1_555`	`5`	`1`	`306`	`38.1`	`0.9`	`0.951`	`0`	`0`	`0`	`0.000`
`10`		[IPA]A:211	`3`	`1`	`198`	`f`	A	x,-y,-z+1	`4_556`	`2`	`1`	`6970`	`21.4`	`0.0`	`0.501`	`0`	`0`	`0`	`0.000`
`11`		[PBP]A:201	`1`	`1`	`306`	`◊`	A	x,-y,-z+1	`4_556`	`1`	`1`	`6970`	`15.8`	`-0.2`	`0.369`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe