3DTY

crystal structure of an oxidoreductase from pseudomonas syringae

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 37
  • Norm. En. per Res.: -3.2534
• 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	-91.446	-20.0441	-329.414	-440.904	145	17	6	11894	8	22	31
A-D	-15.7157	0.0	-104.66	-120.3757	37	1	2	3627	0	0	2
A-E	-25.4258	62.7597	-256.217	-218.8831	123	7	5	9985	0	50	47
B-D	-27.9114	42.1463	-271.67	-257.4351	125	14	5	10953	0	48	51
B-E	-16.2395	0.0	-103.642	-119.8815	38	2	2	3559	0	0	2
D-E	-95.4562	-20.1842	-336.251	-451.8915	146	17	6	12018	8	21	31

Interface residues

• A-B: ALA173A, ALA173B, ALA179A, ALA179B, ALA235A, ALA235B, ALA244A, ALA244B, ALA254A, ALA254B, ALA262A, ALA262B, ALA265A, ALA265B, ALA280A, ALA280B, ALA301A, ALA301B, ALA380A, ALA380B, ARG166A, ARG166B, ARG225A, ARG225B, ARG230A, ARG230B, ARG237A, ARG237B, ARG274A, ARG274B, ARG279A, ARG279B, ASN243A, ASN243B, ASN264A, ASN264B, ASN382A, ASN382B, ASP164A, ASP164B, ASP242A, ASP242B, ASP383A, ASP383B, CYS228A, CYS228B, GLN171A, GLN171B, GLN231A, GLN231B, GLN297A, GLN297B, GLN299A, GLN299B, GLN302A, GLN302B, GLU249A, GLU249B, GLU283A, GLU283B, GLU295A, GLU295B, GLY175A, GLY175B, GLY252A, GLY252B, GLY253A, GLY253B, GLY256A, GLY256B, GLY266A, GLY266B, GLY270A, GLY270B, GLY277A, GLY277B, GLY298A, GLY298B, HIS169A, HIS169B, HIS174A, HIS174B, HIS177A, HIS177B, ILE276A, ILE276B, ILE385A, ILE385B, LEU162A, LEU162B, LEU247A, LEU247B, LEU282A, LEU282B, LYS272A, LYS272B, PHE176A, PHE176B, PHE233A, PHE233B, PHE294A, PHE294B, PRO300A, PRO300B, SER178A, SER178B, SER229A, SER229B, SER232A, SER232B, SER260A, SER260B, SER261A, SER261B, SER267A, SER267B, SER278A, SER278B, SER281A, SER281B, SER293B, SER384A, SER384B, THR246A, THR246B, TRP259A, TRP259B, TRP386A, TRP386B, TYR245A, TYR245B, TYR250A, TYR250B, VAL165A, VAL165B, VAL168A, VAL168B, VAL234A, VAL234B, VAL263A, VAL263B, VAL275A, VAL275B, VAL296A, VAL296B
• A-D: ALA301A, ALA301D, GLN152A, GLN152D, GLN291A, GLN297A, GLN297D, GLN299A, GLN299D, GLN302A, GLN302D, GLU295A, GLU295D, GLU305A, GLU305D, GLY298A, GLY298D, GLY309A, GLY309D, ILE303A, ILE303D, LEU292A, LEU292D, LEU304A, LEU304D, LEU311A, LEU311D, PHE294A, PHE294D, PRO300A, PRO300D, SER293A, SER293D, TYR310A, TYR310D, VAL296A, VAL296D
• A-E: ALA32A, ALA32E, ALA332A, ALA332E, ALA334A, ALA334E, ARG288A, ARG288E, ARG306A, ARG306E, ARG30A, ARG30E, ARG320A, ARG320E, ARG35A, ARG35E, ARG6A, ARG6E, ASN290A, ASN290E, ASN335E, ASN37A, ASN37E, ASP286A, ASP286E, ASP318A, ASP318E, ASP319A, ASP319E, ASP36A, ASP36E, CYS31A, CYS31E, GLN10E, GLN148A, GLN148E, GLN24A, GLN24E, GLN271A, GLN271E, GLN291A, GLN291E, GLN59A, GLN59E, GLU287A, GLU287E, GLU305A, GLU305E, GLU327A, GLU327E, GLU331A, GLU331E, GLY266A, GLY266E, GLY270A, GLY270E, GLY307A, GLY307E, GLY309A, GLY309E, GLY322A, GLY322E, GLY323A, GLY323E, GLY324A, GLY324E, GLY328A, GLY328E, GLY61A, GLY61E, HIS147A, HIS147E, HIS174A, HIS174E, HIS209A, HIS209E, HIS269A, HIS269E, HIS29E, HIS325A, HIS325E, ILE25A, ILE25E, ILE28A, ILE28E, ILE303A, ILE303E, ILE321A, ILE321E, ILE8E, LEU329A, LEU329E, LEU34A, LEU34E, LEU60A, LEU60E, PHE172A, PHE172E, PHE176A, PHE176E, PHE330A, PHE330E, PRO11E, PRO289A, PRO289E, PRO326A, PRO326E, PRO9A, PRO9E, SER267A, SER267E, TRP284A, TRP284E, TRP285A, TRP285E, TRP333A, TRP333E, TYR144A, TYR144E, TYR27A, TYR27E, VAL206A, VAL206E
• B-D: ALA32B, ALA32D, ALA332B, ALA332D, ALA334B, ALA334D, ARG288B, ARG288D, ARG306B, ARG306D, ARG30B, ARG30D, ARG320B, ARG320D, ARG35B, ARG35D, ASN290B, ASN290D, ASN37B, ASN37D, ASP286B, ASP286D, ASP318B, ASP319B, ASP319D, ASP36B, ASP36D, CYS31B, CYS31D, GLN148B, GLN148D, GLN24B, GLN24D, GLN271B, GLN271D, GLN291B, GLN291D, GLN59B, GLN59D, GLU287B, GLU287D, GLU305B, GLU305D, GLU327B, GLU327D, GLU331B, GLU331D, GLY266B, GLY266D, GLY270B, GLY270D, GLY307B, GLY307D, GLY309B, GLY309D, GLY322B, GLY322D, GLY323B, GLY323D, GLY324B, GLY324D, GLY328B, GLY328D, GLY61B, GLY61D, HIS147B, HIS147D, HIS174B, HIS174D, HIS209B, HIS209D, HIS269B, HIS269D, HIS325B, HIS325D, ILE25B, ILE25D, ILE28B, ILE28D, ILE303B, ILE303D, ILE321B, ILE321D, ILE8B, LEU329B, LEU329D, LEU34B, LEU34D, LEU41B, LEU41D, LEU60B, LEU60D, PHE172B, PHE172D, PHE176B, PHE176D, PHE330B, PHE330D, PRO11B, PRO11D, PRO289B, PRO289D, PRO326B, PRO326D, PRO9B, PRO9D, SER23B, SER23D, SER267B, SER267D, TRP284B, TRP284D, TRP285B, TRP285D, TRP333B, TRP333D, TYR144B, TYR144D, TYR27B, TYR27D, TYR310B, VAL206B, VAL206D, VAL62B, VAL62D
• B-E: ALA301B, ALA301E, GLN152B, GLN152E, GLN291B, GLN291E, GLN297B, GLN297E, GLN299B, GLN299E, GLN302B, GLN302E, GLU295B, GLU295E, GLU305B, GLU305E, GLY298B, GLY298E, GLY309B, GLY309E, ILE303B, ILE303E, LEU292B, LEU292E, LEU304B, LEU304E, LEU311B, LEU311E, PHE294B, PHE294E, PRO300B, PRO300E, SER293B, SER293E, TYR310B, TYR310E, VAL296B, VAL296E
• D-E: ALA173D, ALA173E, ALA179D, ALA179E, ALA235D, ALA235E, ALA244D, ALA244E, ALA254D, ALA254E, ALA262D, ALA262E, ALA265D, ALA265E, ALA280D, ALA280E, ALA301D, ALA301E, ALA380D, ALA380E, ARG166D, ARG166E, ARG225D, ARG225E, ARG230D, ARG230E, ARG237D, ARG237E, ARG274D, ARG274E, ARG279D, ARG279E, ASN243D, ASN243E, ASN264D, ASN264E, ASN382D, ASN382E, ASP164D, ASP164E, ASP242D, ASP242E, ASP383D, ASP383E, CYS228D, CYS228E, GLN171D, GLN171E, GLN231D, GLN231E, GLN297D, GLN297E, GLN299D, GLN299E, GLN302D, GLN302E, GLU249D, GLU249E, GLU283D, GLU283E, GLU295D, GLU295E, GLY175D, GLY175E, GLY252D, GLY252E, GLY253D, GLY253E, GLY256D, GLY256E, GLY266D, GLY266E, GLY270D, GLY270E, GLY277D, GLY277E, GLY298D, GLY298E, HIS169D, HIS169E, HIS174D, HIS174E, HIS177D, HIS177E, ILE276D, ILE276E, ILE385D, ILE385E, LEU162D, LEU162E, LEU247D, LEU247E, LEU282D, LEU282E, LYS272D, LYS272E, PHE176D, PHE176E, PHE233D, PHE233E, PHE294D, PHE294E, PRO300D, PRO300E, SER178D, SER178E, SER229D, SER229E, SER232D, SER232E, SER260D, SER260E, SER261D, SER261E, SER267D, SER267E, SER278D, SER278E, SER281D, SER281E, SER293D, SER293E, SER384D, SER384E, THR246D, THR246E, TRP259D, TRP259E, TRP386D, TRP386E, TYR245D, TYR245E, TYR250D, TYR250E, VAL165D, VAL165E, VAL168D, VAL168E, VAL234D, VAL234E, VAL263D, VAL263E, VAL275D, VAL275E, VAL296D, VAL296E