2FSS

candida boidinii formate dehydrogenase (fdh) k47e mutant

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 241
  • Norm. En. per Res.: -5.3166
• Hub Node: A(3)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-2.2257	-1.7232	-12.9347	-16.8836	24	0	0	762	0	13	12
A-C	0.0	3.6993	-20.9028	-17.2035	33	0	2	1207	0	27	23
A-D	-159.2611	-84.3363	-1037.71	-1281.3074	241	43	28	36991	18	99	92
B-C	-140.8202	-92.7374	-1052.21	-1285.7675	245	44	29	38299	18	100	92
C-D	-12.917	-3.7135	-22.1024	-38.7329	26	0	0	1049	0	14	13

Interface residues

• A-B: ALA1A, ALA31A, ARG277B, ASP36A, GLN275B, GLN37A, GLU272B, GLU40A, GLY274B, GLY38A, HIS39A, HIS57A, ILE3A, ILE42A, LEU34A, LEU41A, LYS241B, LYS249B, LYS27A, LYS2A, LYS301B, LYS35A, LYS84A, SER273B
• A-C: ALA10A, ALA14A, ALA14C, ALA15A, ALA15C, ALA31A, ALA31C, ASN26A, ASN26C, ASN32A, ASN32C, ASP16A, ASP16C, ASP9A, ASP9C, CYS23C, GLU17A, GLU17C, GLU18A, GLU18C, GLU25A, GLU25C, GLY11A, GLY11C, LYS12A, LYS12C, LYS27A, LYS27C, LYS35A, LYS35C, THR24A, THR24C, THR43C
• A-D: ALA10A, ALA124A, ALA124D, ALA141A, ALA141D, ALA14A, ALA153A, ALA153D, ALA154A, ALA154D, ALA156A, ALA156D, ALA159A, ALA159D, ALA15A, ALA289A, ALA289D, ALA304A, ALA304D, ALA307A, ALA307D, ALA319A, ALA319D, ARG136A, ARG136D, ARG178A, ARG178D, ARG182A, ARG182D, ARG277A, ARG277D, ARG296A, ARG296D, ARG299A, ARG299D, ARG322A, ARG322D, ASN119A, ASN119D, ASN137A, ASN137D, ASN147A, ASN147D, ASN187A, ASN187D, ASN26D, ASN306A, ASN306D, ASP149A, ASP149D, ASP158A, ASP158D, ASP161A, ASP161D, ASP16A, ASP282A, ASP282D, ASP292A, ASP292D, ASP297A, ASP297D, ASP318A, ASP318D, ASP9A, CYS23A, CYS23D, GLN144A, GLN144D, GLN287A, GLN287D, GLN320A, GLN320D, GLU125A, GLU125D, GLU143A, GLU143D, GLU151A, GLU151D, GLU163A, GLU163D, GLU17A, GLU181A, GLU181D, GLU18A, GLU18D, GLU25A, GLU25D, GLY11A, GLY164A, GLY164D, GLY22A, GLY22D, GLY280A, GLY280D, GLY281A, GLY281D, GLY303A, GLY303D, GLY305A, GLY305D, GLY314A, GLY314D, HIS126A, HIS126D, HIS13A, HIS142A, HIS142D, HIS148A, HIS148D, HIS293A, HIS293D, HIS311A, HIS311D, HIS70A, HIS70D, ILE145A, ILE145D, ILE146A, ILE146D, ILE155A, ILE155D, ILE162A, ILE162D, LEU132A, LEU132D, LEU134A, LEU134D, LEU180A, LEU180D, LEU183A, LEU183D, LEU20A, LEU20D, LEU317A, LEU317D, LYS12A, LYS157A, LYS157D, LYS165A, LYS165D, LYS19A, LYS19D, LYS206A, LYS206D, LYS291A, LYS291D, LYS301D, MET129A, MET129D, MET131A, MET131D, MET298A, MET298D, MET308A, MET308D, PHE138A, PHE138D, PHE186A, PHE186D, PHE285A, PHE285D, PHE69A, PHE69D, PRO140A, PRO140D, PRO185A, PRO185D, PRO188A, PRO188D, PRO286A, PRO286D, PRO288A, PRO288D, PRO290A, PRO290D, PRO294A, PRO310A, PRO310D, SER118A, SER118D, SER122A, SER122D, SER313A, SER313D, THR130A, THR130D, THR24D, THR256A, THR256D, THR309A, THR309D, THR315A, THR315D, THR316A, THR316D, TRP150A, TRP150D, TRP252A, TRP252D, TRP284A, TRP284D, TRP295A, TRP295D, TYR160A, TYR160D, TYR21A, TYR21D, TYR279A, TYR279D, TYR302A, TYR302D, TYR312A, TYR312D, TYR8A, TYR8D, VAL120A, VAL120D, VAL121A, VAL121D, VAL123A, VAL123D, VAL127A, VAL127D, VAL128A, VAL128D, VAL133A, VAL133D, VAL135A, VAL135D, VAL139A, VAL139D, VAL152A, VAL152D, VAL179A, VAL179D, VAL184A, VAL184D, VAL207A, VAL207D, VAL283A, VAL283D
• B-C: ALA10B, ALA10C, ALA124B, ALA124C, ALA141B, ALA141C, ALA14C, ALA153B, ALA153C, ALA154B, ALA154C, ALA156B, ALA156C, ALA159B, ALA159C, ALA15C, ALA289B, ALA289C, ALA304B, ALA304C, ALA307B, ALA307C, ALA319B, ALA319C, ARG136B, ARG136C, ARG178B, ARG178C, ARG182B, ARG182C, ARG277B, ARG277C, ARG296B, ARG296C, ARG299B, ARG299C, ARG322B, ARG322C, ASN119B, ASN119C, ASN137B, ASN137C, ASN147B, ASN147C, ASN187B, ASN187C, ASN306B, ASN306C, ASP149B, ASP149C, ASP158B, ASP158C, ASP161B, ASP161C, ASP16C, ASP282B, ASP282C, ASP292B, ASP292C, ASP297B, ASP297C, ASP318B, ASP318C, ASP9B, ASP9C, CYS23B, CYS23C, GLN144B, GLN144C, GLN287B, GLN287C, GLN320B, GLN320C, GLU125B, GLU125C, GLU143B, GLU143C, GLU151B, GLU151C, GLU163B, GLU163C, GLU17C, GLU181B, GLU181C, GLU18C, GLU25B, GLU25C, GLY11B, GLY11C, GLY164B, GLY164C, GLY22B, GLY22C, GLY250B, GLY280B, GLY280C, GLY281B, GLY281C, GLY303B, GLY303C, GLY305B, GLY305C, GLY314B, GLY314C, HIS126B, HIS126C, HIS13C, HIS142B, HIS142C, HIS148B, HIS148C, HIS293B, HIS293C, HIS311B, HIS311C, HIS70B, HIS70C, ILE145B, ILE145C, ILE146B, ILE146C, ILE155B, ILE155C, ILE162B, ILE162C, LEU132B, LEU132C, LEU134B, LEU134C, LEU180B, LEU180C, LEU183B, LEU183C, LEU20B, LEU20C, LEU317B, LEU317C, LYS12C, LYS157B, LYS157C, LYS165B, LYS165C, LYS19B, LYS19C, LYS206B, LYS206C, LYS291B, LYS291C, LYS301B, LYS301C, MET129B, MET129C, MET131B, MET131C, MET298B, MET298C, MET308B, MET308C, PHE138B, PHE138C, PHE186B, PHE186C, PHE285B, PHE285C, PHE69B, PHE69C, PRO140B, PRO140C, PRO185B, PRO185C, PRO188B, PRO188C, PRO286B, PRO286C, PRO288B, PRO288C, PRO290B, PRO290C, PRO294B, PRO294C, PRO310B, PRO310C, PRO68B, PRO71B, SER118B, SER118C, SER122B, SER122C, SER313B, SER313C, THR130B, THR130C, THR24B, THR256B, THR256C, THR309B, THR309C, THR315B, THR315C, THR316B, THR316C, THR321C, TRP150B, TRP150C, TRP252B, TRP252C, TRP284B, TRP284C, TRP295B, TRP295C, TYR160B, TYR160C, TYR279B, TYR279C, TYR302B, TYR302C, TYR312B, TYR312C, TYR8B, TYR8C, VAL120C, VAL121B, VAL121C, VAL123B, VAL123C, VAL127B, VAL127C, VAL128B, VAL128C, VAL133B, VAL133C, VAL135B, VAL135C, VAL139B, VAL139C, VAL152B, VAL152C, VAL179B, VAL179C, VAL184B, VAL184C, VAL207B, VAL207C, VAL283B, VAL283C
• C-D: ALA1C, ALA269D, ALA31C, ARG277D, ASP36C, GLN275D, GLN37C, GLU272D, GLU40C, GLY250D, GLY274D, GLY38C, HIS39C, HIS57C, ILE42C, LEU34C, LEU41C, LYS249D, LYS27C, LYS2C, LYS301D, LYS35C, SER273D, THR43C, TYR160D, TYR302D