2QW4

human nr4a1 ligand-binding domain

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 49
  • Norm. En. per Res.: -2.2687
• 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	0.0	0.0	-0.457	-0.457	8	0	0	105	0	4	4
A-C	0.0	0.0	-68.4016	-68.4016	47	5	5	3855	0	9	10
A-D	0.0	0.0	-0.486	-0.486	8	0	0	96	0	0	0
B-C	0.0	0.0	-81.9189	-81.9189	44	2	2	3758	0	7	7
B-D	-14.8591	4.0909	-100.396	-111.1642	49	6	6	4248	0	19	16

Interface residues

• A-B: ALA157A, ARG160A, ARG160B, ARG223A, ASP150B, SER161B, SER164A, SER164B
• A-C: ALA145C, ALA201A, ALA218A, ARG141C, ARG199A, ARG223A, ARG232A, ASN198A, ASP150C, ASP153C, CYS174A, CYS203A, CYS220A, GLN197A, GLN57C, GLU194A, GLU195A, GLU206A, GLU230A, GLU58C, GLY226A, GLY65C, HIS140C, HIS63C, ILE200A, LEU142C, LEU175A, LEU178A, LEU204A, LEU221A, LEU224A, LEU225A, LEU228A, LEU59C, LEU61C, LYS205A, LYS227A, LYS66C, PHE64C, PRO217A, PRO229A, PRO62C, SER202A, SER219A, SER222A, VAL208A, VAL60C
• A-D: ALA210A, ALA212A, ARG223D, CYS220D, GLY213A, SER219D, SER222D, VAL211A
• B-C: ARG232B, ARG241B, ARG241C, ASP249B, ASP249C, ASP263B, ASP263C, CYS235B, CYS235C, GLN237B, GLN237C, GLN240B, GLN240C, GLU230B, GLU248B, GLU248C, GLY238B, GLY238C, ILE242B, ILE242C, LEU113B, LEU239B, LEU239C, LEU245B, LEU245C, LEU247B, LEU247C, LYS246B, LYS246C, LYS66C, MET262B, MET262C, PHE243B, PHE243C, PHE261B, PHE261C, THR233B, THR233C, THR236B, THR236C, THR264B, THR264C, TYR244B, TYR244C
• B-D: ALA201D, ARG141B, ARG146B, ARG191D, ARG199D, ARG232D, ASN198D, ASP183D, CYS174D, CYS203D, GLN143B, GLN197D, GLN57B, GLU194D, GLU195D, GLU206D, GLU230D, GLU58B, GLY226D, GLY65B, HIS63B, ILE200D, LEU142B, LEU175D, LEU178D, LEU204D, LEU221D, LEU224D, LEU225D, LEU228D, LEU59B, LEU61B, LYS205D, LYS227D, LYS55B, LYS66B, PHE56B, PHE64B, PRO190D, PRO229D, PRO62B, SER202D, SER219D, SER222D, THR182D, VAL179D, VAL193D, VAL208D, VAL60B