3D1L

crystal structure of putative nadp oxidoreductase bf3122 from bacteroides fragilis

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 229
  • Norm. En. per Res.: -5.3874
• Hub Node: A(1)

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	-139.6366	-111.0126	-983.076	-1233.7252	229	41	32	41217	14	84	90

Interface residues

• A-B: ALA163A, ALA163B, ALA174A, ALA174B, ALA175A, ALA175B, ALA187A, ALA187B, ALA189A, ALA189B, ALA190A, ALA190B, ALA211A, ALA211B, ALA222A, ALA222B, ALA227A, ALA227B, ALA243A, ALA243B, ALA247A, ALA247B, ALA77B, ALA99B, ARG127B, ARG159A, ARG159B, ARG168A, ARG168B, ARG212A, ARG212B, ARG229A, ARG240A, ARG240B, ARG250A, ARG250B, ARG257A, ARG257B, ARG262A, ARG262B, ARG39B, ASN17B, ASN180A, ASN180B, ASN183A, ASN183B, ASN197A, ASN197B, ASN21B, ASN233A, ASN237A, ASN237B, ASP130B, ASP162A, ASP164A, ASP164B, ASP201A, ASP201B, ASP208A, ASP208B, ASP231A, ASP245A, ASP245B, ASP75B, CYS179A, CYS179B, GLN121A, GLN121B, GLN126B, GLN167A, GLN167B, GLN223A, GLN223B, GLN249A, GLN249B, GLU128B, GLU133A, GLU133B, GLU166A, GLU166B, GLU191A, GLU191B, GLU209A, GLU209B, GLU216A, GLU216B, GLU218A, GLU218B, GLU232A, GLU253A, GLU253B, GLU261A, GLU261B, GLY100B, GLY225A, GLY225B, HIS172A, HIS172B, HIS184A, HIS184B, HIS215A, HIS215B, HIS238A, HIS238B, HIS260A, HIS260B, ILE102B, ILE134A, ILE134B, ILE138A, ILE207A, ILE207B, ILE228A, ILE228B, ILE235A, ILE235B, ILE259A, ILE259B, LEU171A, LEU171B, LEU173A, LEU173B, LEU188A, LEU188B, LEU18B, LEU192A, LEU192B, LEU193A, LEU193B, LEU198A, LEU198B, LEU204A, LEU204B, LEU206A, LEU206B, LEU217A, LEU217B, LEU239A, LEU239B, LEU242A, LEU242B, LEU251A, LEU251B, LEU254A, LEU254B, LEU255A, LEU255B, LEU73B, LYS125B, LYS132B, LYS169A, LYS169B, LYS194A, LYS194B, LYS195A, LYS195B, LYS213A, LYS213B, LYS220A, LYS220B, LYS74B, PHE123A, PHE123B, PHE136A, PHE136B, PHE137A, PHE137B, PHE177A, PHE177B, PHE181A, PHE181B, PHE200A, PHE200B, PHE78B, PRO103B, PRO119B, PRO135A, PRO135B, PRO199A, PRO199B, PRO205A, PRO205B, PRO219A, PRO219B, PRO226A, PRO226B, SER101B, SER124B, SER165A, SER170A, SER170B, SER256A, SER256B, SER258A, SER258B, SER76B, THR122A, THR122B, THR178A, THR178B, THR182A, THR182B, THR210A, THR210B, THR221A, THR221B, THR224A, THR224B, TYR118A, TYR118B, TYR161A, TYR161B, TYR186A, TYR186B, TYR196A, TYR196B, TYR230B, TYR252A, TYR252B, VAL129B, VAL160A, VAL176A, VAL176B, VAL202A, VAL202B, VAL214A, VAL214B, VAL234A, VAL234B