2MTA

crystal structure of a ternary electron transfer complex between methylamine dehydrogenase, amicyanin and a c-type cytochrome

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: H-L
  • Int. Res.: 145
  • Norm. En. per Res.: -4.8246
• Hub Node: H(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
H-L	-147.8117	-84.8609	-466.899	-699.5716	145	26	10	18377	10	56	47
H-A	-5.1086	-41.5787	-59.4263	-106.1135	34	1	0	2485	3	10	7
H-C	0.0	3.5137	-0.4644	3.0494	7	0	0	75	0	2	4
L-A	0.0	-9.0067	-95.123	-104.1297	57	2	3	4878	0	15	13
A-C	-10.1971	18.8909	-107.745	-99.0512	50	1	1	4156	1	20	16

Interface residues

• H-L: ALA103L, ALA116L, ALA117H, ALA11L, ALA296H, ALA40H, ALA43H, ALA44H, ALA55L, ALA90H, ARG10L, ARG119H, ARG184H, ARG265H, ARG288H, ARG292H, ARG298H, ARG88H, ARG91H, ARG94H, ARG99L, ASN104L, ASN216H, ASN34L, ASN81L, ASN90L, ASP105L, ASP114L, ASP115L, ASP167H, ASP185H, ASP211H, ASP24L, ASP286H, ASP289H, ASP321H, ASP32L, ASP8L, CYS109L, CYS121L, CYS168H, CYS183H, CYS23L, CYS29L, CYS78L, CYS88L, GLN142H, GLN287H, GLN365H, GLU101L, GLU210H, GLU212H, GLU290H, GLU319H, GLU92L, GLU93H, GLU94L, GLY111L, GLY123H, GLY186H, GLY263H, GLY267H, GLY268H, GLY33L, GLY49L, GLY79L, GLY84L, GLY92H, GLY93L, HIS120L, HIS170H, HIS182H, HIS208H, HIS217H, HIS28L, HIS293H, HIS318H, HIS41H, ILE106L, ILE107L, ILE215H, ILE31L, ILE320H, ILE89H, LEU121H, LEU214H, LEU67H, LEU89L, LEU95L, LYS12L, LYS294H, LYS51L, MET117L, MET128H, PHE102L, PHE110L, PHE120H, PHE143H, PHE213H, PHE299H, PHE42H, PHE66H, PHE86H, PRO100L, PRO145H, PRO209H, PRO218H, PRO230H, PRO39H, PRO87L, PRO96L, PRO9L, SER144H, SER297H, SER30L, SER83L, THR118L, THR122L, THR124H, THR231H, THR295H, THR50L, THR7L, THR84H, THR91L, TRP108L, TRP13L, TRP229H, TRP264H, TRP269H, TRP291H, TYR119L, TYR125H, TYR141H, TYR169H, TYR232H, TYR80L, TYR98L, VAL122H, VAL14L, VAL285H, VAL45H, VAL82L, VAL85H, VAL97L
• H-A: ALA146H, ALA59A, ALA66A, ARG184H, ARG99A, ASP164H, ASP167H, CYS168H, CYS92A, GLN142H, HIS53A, HIS56A, HIS91A, HIS95A, LYS27A, LYS29A, LYS68A, MET28A, MET51A, MET98A, PHE143H, PHE57A, PHE97A, PRO145H, PRO147H, PRO166H, PRO94A, PRO96A, SER144H, THR93A, TYR141H, TYR169H, VAL165H, VAL58A
• H-C: ASP127C, ASP185H, GLN146C, GLU210H, PRO147C, PRO209H, VAL206H
• L-A: ALA103L, ALA112L, ALA130L, ALA50A, ALA53L, ALA55L, ALA59L, ALA73L, ARG75L, ARG99L, ASN54A, ASP115L, CYS109L, CYS92A, GLN76A, GLU101L, GLU113L, GLU49A, GLY111L, GLY128L, GLY69A, HIS53A, HIS56A, HIS91A, HIS95A, ILE106L, ILE126L, ILE72L, LEU71L, LYS129L, LYS68A, LYS73A, LYS74A, MET28A, MET51A, MET71A, MET72A, MET98A, PHE102L, PHE110L, PHE97A, PRO100L, PRO125L, PRO52A, PRO70A, PRO94A, PRO96A, SER56L, SER60L, THR54L, THR93A, TRP108L, TYR74L, TYR98L, VAL127L, VAL58L, VAL97L
• A-C: ALA26A, ALA65C, ALA76C, ARG48A, ASN74C, ASP127C, ASP130C, ASP24A, ASP75C, CYS60C, GLN100C, GLU31A, GLU34A, GLU49A, GLU66C, GLU75A, GLY126C, GLY19A, GLY62C, GLY67C, GLY70C, GLY72C, HIS36A, HIS61C, ILE25A, ILE46A, ILE69C, LEU35A, LEU73C, LYS101A, LYS129C, LYS27A, LYS29A, LYS68C, MET28A, PRO33A, PRO71C, PRO81C, THR125C, THR32A, THR79C, THR98C, TRP78C, TYR124C, TYR30A, TYR77C, TYR80C, VAL103A, VAL22A, VAL23A