3QLY

candida glabrata dihydrofolate reductase complexed with nadph and 6- methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1- yl]pyrimidine-2,4-diamine (ucp115a)

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 116
  • Norm. En. per Res.: -4.374
• 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	-119.322	-95.8527	-292.214	-507.3887	116	18	0	9941	8	92	69

Interface residues

• A-B: ARG128A, ARG128B, ARG165A, ARG165B, ARG79A, ARG79B, ARG99A, ARG99B, ASN100A, ASN100B, ASN96A, ASN96B, ASP132A, ASP132B, ASP154A, ASP154B, ASP82A, ASP82B, CYS101A, CYS101B, GLN129A, GLN129B, GLN158A, GLN158B, GLN160A, GLN160B, GLN164A, GLN164B, GLU125A, GLU125B, GLU161A, GLU161B, GLU163A, GLU163B, GLU16A, GLU16B, GLU195A, GLU195B, GLU219A, GLU219B, GLU84A, GLU84B, GLY18A, GLY18B, GLY83A, GLY83B, HIS220A, HIS220B, HIS221A, HIS221B, HIS222A, HIS222B, HIS223A, HIS223B, HIS224A, HIS224B, HIS225A, HIS225B, HIS226A, HIS226B, HIS227A, HIS227B, ILE126A, ILE126B, ILE150A, ILE150B, LEU133A, LEU133B, LEU14A, LEU14B, LEU157A, LEU157B, LEU162A, LEU162B, LEU218A, LEU218B, LEU98A, LEU98B, LYS159A, LYS159B, LYS216A, LYS216B, LYS217A, LYS217B, MET131A, MET131B, MET153A, MET153B, MET17A, MET17B, PHE156A, PHE156B, PHE166A, PHE166B, PHE81A, PHE81B, PRO15A, PRO15B, SER130A, SER130B, SER78A, SER78B, SER80A, SER80B, SER95A, SER95B, SER97A, SER97B, THR103A, THR103B, THR155A, THR155B, TYR127A, TYR127B, VAL77A, VAL77B