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Interfaces in PDB 5u13 crystal.
Space symmetry group: C 1 2 1. Resolution: 1.95 Å

E. COLI DIHYDROPTEROATE SYNTHASE COMPLEXED WITH AN 8-MERCAPTOGUANINE DERIVATIVE: 2-AMINO-8-{[2-(4-METHOXYPHENYL)-2-OXOETHYL]SULFANYL}-1,7- DIHYDRO-6H-PURIN-6-ONE

Interfaces

##			Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
Id	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	`1`		B	`141`	`37`	`12254`	`◊`	A	x,y,z	`1_555`	`138`	`36`	`12213`	`1288.9`	`-23.8`	`0.003`	`6`	`0`	`0`	`0.928`
2	`2`		B	`62`	`18`	`12254`	`◊`	A	-x,y,-z	`2_555`	`62`	`20`	`12213`	`544.7`	`0.5`	`0.720`	`9`	`2`	`0`	`0.118`
3	`3`		[YH5]B:301	`23`	`1`	`530`	`f`	B	x,y,z	`1_555`	`53`	`22`	`12254`	`370.0`	`2.1`	`0.571`	`6`	`0`	`0`	`0.100`
	`4`		[YH5]A:301	`23`	`1`	`525`	`f`	A	x,y,z	`1_555`	`54`	`22`	`12213`	`356.7`	`2.0`	`0.572`	`8`	`0`	`0`	`0.100`
	*Average:*													`363.4`	`2.1`	`0.572`	`7`	`0`	`0`	`0.100`
4	`5`		B	`30`	`8`	`12254`	`◊`	A	-x+1/2,y-1/2,-z	`4_545`	`35`	`12`	`12213`	`288.1`	`-0.5`	`0.600`	`6`	`4`	`0`	`0.000`
5	`6`		B	`21`	`7`	`12254`	`◊`	A	x,y,z-1	`1_554`	`18`	`7`	`12213`	`179.6`	`-2.2`	`0.271`	`1`	`2`	`0`	`0.000`
6	`7`		[YH5]A:301	`3`	`1`	`525`	`◊`	B	-x,y,-z	`2_555`	`5`	`3`	`12254`	`33.9`	`-0.0`	`0.437`	`0`	`0`	`0`	`0.001`
7	`8`		A	`2`	`1`	`12213`	`◊`	A	-x+1,y,-z+1	`2_656`	`2`	`1`	`12213`	`19.8`	`-0.0`	`0.580`	`0`	`0`	`0`	`0.000`
8	`9`		B	`1`	`1`	`12254`	`◊`	B	-x+1,y,-z	`2_655`	`1`	`1`	`12254`	`8.0`	`-0.3`	`0.253`	`0`	`0`	`0`	`0.000`
9	`10`		A	`3`	`1`	`12213`	`x`	A	-x+1/2,y-1/2,-z+1	`4_546`	`3`	`2`	`12213`	`5.8`	`-0.2`	`0.512`	`0`	`0`	`0`	`0.000`

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

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Protein Data Bank in Europe

Bringing Structure to Biology

PDBePISA

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