1NVJ

deletion mutant (delta 141) of molybdopterin synthase

• Total interactions analyzed: 15
• Total true interactions: 10
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 118
  • Norm. En. per Res.: -4.8695
• Hub Node: A(5)

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	-170.4621	-34.5069	-369.634	-574.6029	118	31	7	14042	2	31	45
A-C	-31.6213	-12.1883	-82.9748	-126.7844	32	3	0	2609	3	16	9
A-D	0.0	0.0	-0.0162	-0.0162	2	0	0	6	0	0	3
A-E	0.0	16.2831	-11.5812	4.7019	18	0	0	545	0	12	12
A-F	0.0	0.0	-0.0737	-0.0737	4	0	0	12	0	1	7
B-C	-35.2292	-53.3597	-116.267	-204.8559	54	10	0	4128	4	36	27
B-E	0.0	0.0	-0.0063	-0.0063	3	0	0	3	0	1	6
B-F	0.0	11.7529	-66.107	-54.3541	36	0	0	2559	0	5	8
C-D	-160.7251	-32.8292	-381.521	-575.0753	123	25	7	14164	2	34	48
E-F	-147.2205	-36.1287	-383.34	-566.6891	117	29	7	14268	2	28	43

Interface residues

• A-B: ALA102A, ALA102B, ALA107A, ALA107B, ALA110A, ALA110B, ALA23A, ALA23B, ALA30A, ALA30B, ARG104A, ARG104B, ARG25A, ARG25B, ARG39A, ARG39B, ASN40B, ASN42B, ASP116A, ASP116B, ASP26A, ASP26B, ASP28A, ASP28B, ASP92A, ASP92B, GLN112A, GLN112B, GLU109A, GLU109B, GLU17A, GLU17B, GLU18A, GLU18B, GLU24A, GLU24B, GLU27A, GLU27B, GLU93A, GLU93B, GLY111A, GLY111B, GLY16A, GLY16B, GLY29A, GLY29B, GLY36A, GLY36B, GLY91A, GLY91B, GLY98A, GLY98B, HIS103A, HIS103B, HIS41B, ILE114A, ILE114B, ILE94A, ILE94B, LEU118A, LEU118B, LEU22A, LEU22B, LYS119A, LYS119B, LYS37A, LYS37B, MET115A, MET115B, PHE108A, PHE108B, PHE113A, PHE113B, PHE13A, PHE13B, PHE34A, PHE34B, PHE96A, PHE96B, PRO20A, PRO20B, PRO90A, PRO90B, SER101A, SER101B, SER105A, SER105B, SER106A, SER106B, SER14A, SER14B, THR100A, THR100B, THR120A, THR120B, THR33A, THR33B, THR35A, THR35B, TRP21A, TYR117A, TYR117B, TYR19A, TYR19B, VAL15A, VAL15B, VAL31A, VAL31B, VAL32A, VAL32B, VAL38A, VAL38B, VAL95A, VAL95B, VAL97A, VAL97B, VAL99A, VAL99B
• A-C: ALA102A, ALA102C, ALA107A, ALA110C, ALA2C, ALA30A, ALA70C, ARG104A, ARG71C, ARG73A, ARG73C, ASN72C, ASP68C, GLU109A, GLU109C, GLU69C, GLY29A, GLY77C, HIS103A, HIS103C, LEU76C, PHE108A, PHE113C, PRO75A, PRO75C, SER101A, SER101C, SER105A, SER106A, SER106C, TRP74A, TRP74C
• A-D: ASN42D, ASN72A
• A-E: ARG25A, ARG78A, ARG78E, GLU17A, GLU17E, GLU24A, GLU24E, GLU3A, GLU3E, GLY16A, GLY16E, LYS5E, PRO20A, PRO20E, TRP21A, TRP21E, TYR19A, TYR19E
• A-F: ASP26A, GLU17F, PRO12F, SER14F
• B-C: ALA122B, ALA2C, ALA62C, ALA64C, ALA70C, ARG121B, ARG121C, ARG127B, ARG39B, ARG71C, ARG73C, ASN40B, ASN42B, ASN72C, ASP116B, ASP68C, GLN112B, GLU3C, GLU65C, GLU69C, GLY36B, GLY44B, HIS41B, ILE114B, ILE66C, ILE94B, LEU118B, LEU43B, LEU50B, LEU52B, LEU76C, LYS119B, LYS126B, LYS37B, LYS61C, MET115B, MET58C, PHE113B, PHE113C, PHE124B, PHE34B, PRO123B, PRO75C, THR120B, THR4C, THR51B, TRP125B, TRP74C, TYR117B, TYR117C, TYR55C, VAL38B, VAL67C, VAL95B
• B-E: ASP26E, PRO12B, SER14B
• B-F: ALA49B, ALA49F, ARG84B, ARG84F, ASN48B, ASN48F, ASP92B, ASP92F, GLN11B, GLN11F, GLU17F, GLU87B, GLU87F, GLY86B, GLY86F, GLY91B, GLY91F, GLY9B, GLY9F, ILE85B, ILE85F, LEU43B, LEU88B, LEU88F, PRO10B, PRO10F, PRO12B, PRO12F, PRO90B, PRO90F, SER46B, THR51B, THR51F, TRP89B, TRP89F, VAL47B
• C-D: ALA102C, ALA102D, ALA107C, ALA107D, ALA110C, ALA110D, ALA23C, ALA23D, ALA30C, ALA30D, ARG104C, ARG104D, ARG140D, ARG25C, ARG25D, ARG39C, ARG39D, ARG78D, ASN40C, ASN40D, ASP116C, ASP116D, ASP26C, ASP26D, ASP28C, ASP28D, ASP92C, ASP92D, GLN112C, GLN112D, GLU109C, GLU109D, GLU17C, GLU17D, GLU18C, GLU18D, GLU24C, GLU24D, GLU27C, GLU27D, GLU93C, GLU93D, GLY111C, GLY111D, GLY16C, GLY16D, GLY29C, GLY29D, GLY36C, GLY36D, GLY91C, GLY91D, GLY98C, GLY98D, HIS103C, HIS103D, HIS41C, HIS41D, ILE114C, ILE114D, ILE94C, ILE94D, LEU118C, LEU118D, LEU22C, LEU22D, LYS119C, LYS119D, LYS37C, LYS37D, MET115C, MET115D, PHE108C, PHE108D, PHE113C, PHE113D, PHE13C, PHE13D, PHE34C, PHE34D, PHE96C, PHE96D, PRO20C, PRO20D, PRO90C, PRO90D, SER101C, SER101D, SER105C, SER105D, SER106C, SER106D, SER14C, SER14D, THR100C, THR100D, THR120C, THR120D, THR33C, THR33D, THR35C, THR35D, TRP21D, TRP89C, TRP89D, TYR117C, TYR117D, TYR19C, TYR19D, VAL15C, VAL15D, VAL31C, VAL31D, VAL32C, VAL32D, VAL38C, VAL38D, VAL95C, VAL95D, VAL97C, VAL97D, VAL99C, VAL99D
• E-F: ALA102E, ALA102F, ALA107E, ALA107F, ALA110E, ALA110F, ALA23E, ALA23F, ALA30E, ALA30F, ARG104E, ARG104F, ARG25E, ARG25F, ARG39E, ARG39F, ASN40E, ASN40F, ASP116E, ASP116F, ASP26E, ASP26F, ASP28E, ASP28F, ASP92E, ASP92F, GLN112E, GLN112F, GLU109E, GLU109F, GLU17E, GLU17F, GLU18E, GLU18F, GLU24E, GLU24F, GLU27E, GLU27F, GLU93E, GLU93F, GLY111E, GLY111F, GLY16E, GLY16F, GLY29E, GLY29F, GLY36E, GLY36F, GLY91E, GLY91F, GLY98E, GLY98F, HIS103E, HIS103F, ILE114E, ILE114F, ILE94E, ILE94F, LEU118E, LEU118F, LEU22E, LEU22F, LYS119E, LYS119F, LYS37E, LYS37F, MET115E, MET115F, PHE108E, PHE108F, PHE113E, PHE113F, PHE13E, PHE13F, PHE34E, PHE34F, PHE96E, PHE96F, PRO20E, PRO20F, PRO90E, PRO90F, SER101E, SER101F, SER105E, SER105F, SER106E, SER106F, SER14E, SER14F, THR100E, THR100F, THR120E, THR120F, THR33E, THR33F, THR35E, THR35F, TRP21F, TYR117E, TYR117F, TYR19E, TYR19F, VAL15E, VAL15F, VAL31E, VAL31F, VAL32E, VAL32F, VAL38E, VAL38F, VAL95E, VAL95F, VAL97E, VAL97F, VAL99E, VAL99F