1ULG

cgl2 in complex with thomsen-friedenreich antigen

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 72
  • Norm. En. per Res.: -5.103
• 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	-35.7841	-30.887	-184.454	-251.1252	89	6	4	8894	12	15	12
A-C	-55.7333	-70.8033	-240.882	-367.4186	72	16	0	7885	8	4	7
A-D	0.0	0.0	-20.8506	-20.8506	28	4	0	840	0	0	0
B-C	0.0	0.0	-18.4654	-18.4654	28	6	0	988	0	0	0
B-D	-48.5099	-68.6407	-243.633	-360.7836	72	15	0	8035	8	4	7
C-D	-25.7528	-35.5501	-227.489	-288.7919	94	10	4	9652	11	15	14

Interface residues

• A-B: ALA150A, ALA150B, ALA23A, ALA23B, ALA24A, ALA24B, ARG103A, ARG103B, ARG26A, ARG26B, ARG85A, ARG85B, ARG99A, ARG99B, ASN113A, ASN113B, ASP105A, ASP105B, ASP139A, ASP139B, ASP95A, ASP95B, ASP98A, ASP98B, GLN101A, GLN101B, GLU20A, GLU20B, GLY107A, GLY107B, GLY142A, GLY142B, GLY97A, GLY97B, HIS141A, HIS141B, HIS96A, HIS96B, ILE102A, ILE110A, ILE110B, ILE94A, ILE94B, LEU143A, LEU143B, LEU144A, LEU144B, LEU147A, LEU147B, LEU2A, LEU2B, LYS18A, LYS18B, MET1A, MET1B, PHE100A, PHE100B, PHE104A, PHE104B, PRO145A, PRO145B, PRO146A, PRO146B, PRO148A, PRO148B, PRO149A, PRO149B, PRO19A, PRO19B, SER109A, SER109B, SER90A, SER90B, THR108A, THR108B, THR137A, THR137B, THR92A, THR92B, TYR106A, TYR106B, TYR111A, TYR111B, VAL140A, VAL140B, VAL22A, VAL22B, VAL93A, VAL93B
• A-C: ALA150A, ALA150C, ALA24A, ALA24C, ALA29A, ALA29C, ARG26A, ARG26C, ASN88A, ASN88C, ASP139A, ASP139C, GLN14A, GLN14C, HIS141A, HIS141C, HIS4A, HIS4C, ILE25A, ILE25C, LEU147A, LEU147C, LEU2A, LEU2C, LEU5A, LEU5C, MET1A, MET1C, PHE132A, PHE132C, PHE6A, PHE6C, PRO135A, PRO135C, PRO145A, PRO145C, PRO146A, PRO146C, PRO148A, PRO148C, PRO149A, PRO149C, PRO86A, PRO86C, PRO87A, PRO87C, PRO89A, PRO89C, SER133A, SER133C, SER134A, SER134C, SER27A, SER27C, SER28A, SER28C, SER90A, SER90C, THR137A, THR137C, TYR125A, TYR125C, TYR3A, TYR3C, VAL11A, VAL11C, VAL136A, VAL136C, VAL138A, VAL138C, VAL140A, VAL140C
• A-D: ALA150A, ALA150D, ALA24A, ALA24D, ARG26A, ARG26D, ARG85A, ARG85D, ASN88A, ASN88D, ASP139A, ASP139D, HIS141A, HIS141D, LEU147A, LEU147D, PRO145A, PRO145D, PRO146A, PRO146D, PRO148A, PRO148D, PRO149A, PRO149D, SER90A, SER90D, THR137A, THR137D
• B-C: ALA150B, ALA150C, ALA24B, ALA24C, ARG26B, ARG26C, ARG85B, ARG85C, ASN88B, ASN88C, ASP139B, ASP139C, HIS141B, HIS141C, LEU147B, LEU147C, PRO145B, PRO145C, PRO146B, PRO146C, PRO148B, PRO148C, PRO149B, PRO149C, SER90B, SER90C, THR137B, THR137C
• B-D: ALA150B, ALA150D, ALA24B, ALA24D, ALA29B, ALA29D, ARG26B, ARG26D, ARG85B, ASN88B, ASN88D, ASP139B, ASP139D, GLN14B, GLN14D, HIS141B, HIS141D, HIS4B, HIS4D, ILE25B, ILE25D, LEU147B, LEU147D, LEU2B, LEU2D, LEU5B, LEU5D, MET1B, MET1D, PHE132B, PHE132D, PHE6B, PHE6D, PRO135B, PRO135D, PRO145B, PRO145D, PRO146B, PRO146D, PRO148B, PRO148D, PRO149B, PRO149D, PRO86B, PRO86D, PRO87B, PRO87D, PRO89B, PRO89D, SER133B, SER133D, SER134B, SER134D, SER27B, SER27D, SER28B, SER28D, SER90B, SER90D, THR137B, THR137D, TYR125B, TYR3B, TYR3D, VAL11B, VAL11D, VAL136B, VAL136D, VAL138B, VAL138D, VAL140B, VAL140D
• C-D: ALA150C, ALA150D, ALA23C, ALA23D, ALA24C, ALA24D, ARG103C, ARG103D, ARG26C, ARG26D, ARG85C, ARG85D, ARG99C, ARG99D, ASN113C, ASN113D, ASP105C, ASP105D, ASP139C, ASP139D, ASP95C, ASP95D, ASP98C, ASP98D, GLN101C, GLN101D, GLU20C, GLU20D, GLY107C, GLY107D, GLY142C, GLY142D, GLY97C, GLY97D, HIS141C, HIS141D, HIS96C, HIS96D, ILE102C, ILE110C, ILE110D, ILE25D, ILE94C, ILE94D, LEU143C, LEU143D, LEU144C, LEU144D, LEU147C, LEU147D, LEU2C, LEU2D, LYS114C, LYS114D, LYS18C, LYS18D, MET1C, MET1D, PHE100C, PHE100D, PHE104C, PHE104D, PRO145C, PRO145D, PRO146C, PRO146D, PRO148C, PRO148D, PRO149C, PRO149D, PRO19C, PRO19D, SER109C, SER109D, SER21C, SER90C, SER90D, THR108C, THR108D, THR137C, THR137D, THR92C, THR92D, TYR106C, TYR106D, TYR111C, TYR111D, TYR112D, VAL140C, VAL140D, VAL22C, VAL22D, VAL93C, VAL93D