3IPV

crystal structure of spatholobus parviflorus seed lectin

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 100
  • Norm. En. per Res.: -4.0107
• 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	-8.2994	-11.6032	-219.382	-239.2847	99	11	10	10732	0	11	12
A-C	-12.3285	-25.7809	1.0603	-37.0491	16	5	0	313	2	6	8
A-D	-106.3393	-28.9003	-265.826	-401.0656	100	20	3	10191	2	18	12
B-C	-102.6055	-25.7937	-259.961	-388.3602	98	21	3	10077	2	20	12
B-D	0.0	0.0	-0.0014	-0.0014	2	0	0	4	0	0	1
C-D	-8.3065	-2.1222	-229.545	-239.9737	103	20	10	10959	0	11	12

Interface residues

• A-B: ALA165A, ALA165B, ALA175A, ALA175B, ALA181A, ALA181B, ALA195A, ALA195B, ALA234B, ALA68B, ALA71B, ARG75A, ARG75B, ASN173A, ASN173B, ASP196A, ASP196B, ASP244A, ASP249A, GLU3B, GLY250A, GLY251A, ILE153A, ILE170B, ILE193A, ILE193B, ILE197A, ILE197B, LEU169A, LEU169B, LEU178A, LEU178B, LEU179A, LEU179B, LEU183A, LEU183B, LEU194A, LEU194B, LEU237B, LEU248A, LYS154A, LYS154B, LYS167A, LYS167B, LYS177A, LYS177B, LYS189A, LYS189B, LYS236B, LYS243A, PHE145A, PHE145B, PHE192A, PHE192B, PHE233B, PHE247A, PHE6B, PHE70B, PHE74B, PRO186A, PRO186B, SER174B, SER182A, SER182B, SER187A, SER187B, SER188A, SER188B, SER191A, SER191B, SER232B, SER235B, SER245A, SER246A, SER5B, SER69B, SER73B, THR171A, THR171B, THR190A, THR190B, THR4B, THR72B, TRP231B, TYR172B, TYR185A, TYR185B, VAL156A, VAL156B, VAL168B, VAL176A, VAL176B, VAL180A, VAL180B, VAL184A, VAL184B, VAL198A, VAL198B, VAL7B
• A-C: ALA1A, ALA1C, ALA234C, GLU3A, GLU3C, LYS236A, LYS236C, LYS243A, LYS243C, SER235C, SER246A, SER246C, SER5A, SER5C, THR242C, THR4C
• A-D: ALA1A, ALA1D, ALA234A, ALA234D, ALA238A, ALA238D, ALA55A, ALA55D, ALA63A, ALA63D, ARG209A, ARG209D, ASN17A, ASN17D, ASN58A, ASN58D, ASP61A, ASP61D, GLU15A, GLU15D, GLU206A, GLU206D, GLU2A, GLU2D, GLU3A, GLU3D, GLY239A, GLY239D, GLY250A, GLY251A, GLY65A, GLY65D, ILE19A, ILE19D, ILE57A, ILE57D, ILE59A, ILE59D, LEU14A, LEU14D, LEU18A, LEU18D, LEU237A, LEU237D, LEU66A, LEU66D, LYS10A, LYS10D, LYS12A, LYS12D, LYS236A, LYS236D, PHE11A, PHE11D, PHE233A, PHE233D, PHE6A, PHE6D, PHE8A, PHE8D, PRO13A, PRO13D, PRO16A, PRO16D, PRO205A, PRO205D, PRO56A, PRO56D, SER230A, SER230D, SER232A, SER232D, SER235A, SER235D, SER54A, SER54D, SER5A, SER5D, SER62A, SER62D, SER9A, SER9D, THR4A, THR4D, THR64A, THR64D, TRP207A, TRP207D, TRP231A, TRP231D, TRP60A, TRP60D, TYR53A, TYR53D, VAL208A, VAL208D, VAL7A, VAL7D, VAL97A, VAL97D
• B-C: ALA1B, ALA1C, ALA234B, ALA234C, ALA238B, ALA238C, ALA55B, ALA55C, ALA63B, ALA63C, ARG209B, ARG209C, ASN17B, ASN17C, ASN58B, ASN58C, ASP61B, ASP61C, GLU15B, GLU15C, GLU206B, GLU206C, GLU2B, GLU2C, GLU3B, GLU3C, GLY239B, GLY239C, GLY250C, GLY251C, GLY65C, ILE19B, ILE19C, ILE57B, ILE57C, ILE59B, ILE59C, LEU14B, LEU14C, LEU18B, LEU18C, LEU237B, LEU237C, LEU66B, LEU66C, LYS10B, LYS10C, LYS12B, LYS12C, LYS236B, LYS236C, PHE11B, PHE11C, PHE233B, PHE233C, PHE6B, PHE6C, PHE8B, PHE8C, PRO13B, PRO13C, PRO16B, PRO16C, PRO205B, PRO56B, PRO56C, SER230B, SER230C, SER232B, SER232C, SER235B, SER235C, SER54B, SER54C, SER5B, SER5C, SER62B, SER62C, SER9B, SER9C, THR4B, THR4C, THR64B, THR64C, TRP207B, TRP207C, TRP231B, TRP231C, TRP60B, TRP60C, TYR53B, TYR53C, VAL208B, VAL208C, VAL7B, VAL7C, VAL97B, VAL97C
• B-D: LYS236B, LYS236D
• C-D: ALA165C, ALA165D, ALA175C, ALA175D, ALA181C, ALA181D, ALA195C, ALA195D, ALA234D, ALA68D, ALA71C, ALA71D, ARG75C, ARG75D, ASN173C, ASN173D, ASP196C, ASP196D, ASP244C, ASP249C, GLU3D, GLY250C, GLY251C, ILE170D, ILE193C, ILE193D, ILE197C, ILE197D, LEU169C, LEU169D, LEU178C, LEU178D, LEU179C, LEU179D, LEU183C, LEU183D, LEU194C, LEU194D, LEU237D, LEU248C, LYS154C, LYS154D, LYS167C, LYS167D, LYS177C, LYS177D, LYS189C, LYS189D, LYS236D, LYS243C, PHE145C, PHE145D, PHE192C, PHE192D, PHE233D, PHE247C, PHE6D, PHE70D, PHE74D, PHE8D, PRO186C, PRO186D, SER174D, SER182C, SER182D, SER187C, SER187D, SER188C, SER188D, SER191C, SER191D, SER230D, SER232D, SER235D, SER245C, SER246C, SER5D, SER69D, SER73D, SER9D, THR171C, THR171D, THR190C, THR190D, THR242C, THR4D, THR72D, TRP231D, TYR172D, TYR185C, TYR185D, VAL156C, VAL156D, VAL168D, VAL176C, VAL176D, VAL180C, VAL180D, VAL184C, VAL184D, VAL198C, VAL198D, VAL7D