2PCP

antibody fab complexed with phencyclidine

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 192
  • Norm. En. per Res.: -2.5866
• 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	-28.858	-15.2606	-452.513	-496.6316	192	30	9	18791	1	26	15
A-C	-37.6404	2.452	-103.169	-138.3574	63	12	0	4841	0	18	15
A-D	0.0	0.0	-0.8389	-0.8389	12	0	0	187	0	0	0
B-C	0.0	0.0	-0.1234	-0.1234	8	0	0	42	0	0	0
B-D	-10.1213	0.0	-54.5956	-64.7169	27	17	2	2393	0	0	0
C-D	-17.1714	-7.5425	-423.329	-448.0428	192	26	7	17911	1	28	15

Interface residues

• A-B: ALA125B, ALA129B, ALA130A, ALA130B, ALA176B, ALA94A, ARG199B, ARG211A, ARG94B, ASN137A, ASN138A, ASN161A, ASN210A, ASN28A, ASN30A, ASN37B, ASN53A, ASN60B, ASP101B, ASP165A, ASP167A, ASP170A, ASP1A, ASP1A5, ASP98B, ASP99B, CB8.61466-3.94341, CB8.93646-19.59473, CYS134A, CYS142B, CYS194A, CYS88A, CYS92B, GLN105B, GLN124A, GLN131B, GLN179B, GLN38A, GLN39B, GLN42A, GLN6B, GLN90A, GLU123A, GLU34A, GLU46B, GLY100A, GLY101A, GLY104B, GLY106B, GLY127B, GLY128A, GLY129A, GLY141B, GLY158A, GLY169B, GLY41A, GLY42B, GLY49B, GLY58B, GLY91A, GLY93B, GLY99A, HIS172B, HIS27A, HIS35B, HIS61B, ILE117A, ILE205A, ILE223B, ILE48A, ILE48B, LEU124B, LEU125A, LEU136A, LEU140B, LEU143B, LEU154B, LEU160A, LEU178B, LEU179A, LEU181A, LEU184B, LEU187B, LEU33A, LEU45B, LEU46A, LEU4B, LEU9A, LYS103A, LYS145B, LYS169A, LYS207A, LYS221B, LYS222B, LYS38B, LYS39A, LYS43B, LYS45A, LYS50A, LYS62B, MET137B, MET175A, PHE100B, PHE118A, PHE135A, PHE139A, PHE174B, PHE209A, PHE55A, PHE63B, PHE89A, PHE98A, PRO119A, PRO120A, PRO123B, PRO126B, PRO175B, PRO40A, PRO44A, PRO95A, SER116A, SER120B, SER121A, SER122A, SER127A, SER128B, SER131A, SER162A, SER168B, SER174A, SER176A, SER177A, SER180B, SER188B, SER189B, SER190B, SER208A, SER43A, SER44B, SER56A, SER95B, THR107B, THR114A, THR126A, THR139B, THR164A, THR172A, THR173B, THR178A, THR180A, THR182A, THR186B, THR192B, THR31A, THR96B, THR97A, TRP103B, TRP157B, TRP163A, TRP36B, TRP47B, TRP97B, TYR102B, TYR122B, TYR173A, TYR185B, TYR192A, TYR32A, TYR36A, TYR49A, TYR50B, TYR59B, TYR86A, TYR87A, TYR91B, TYR96A, VAL115A, VAL121B, VAL132A, VAL133A, VAL138B, VAL144B, VAL159A, VAL171B, VAL177B, VAL191B, VAL206A, VAL226B, VAL2B, VAL51A, VAL85A, VAL89B
• A-C: ALA112A, ALA112C, ALA196A, ALA196C, ARG188A, ARG188C, ARG211A, ARG211C, ASN190A, ASN190C, ASN210A, ASN210C, ASP151A, ASP151C, CYS194A, GLU195A, GLU195C, GLY152A, GLY152C, HIS189A, HIS189C, HIS198C, ILE150A, ILE150C, ILE205A, ILE205C, LYS147A, LYS149A, LYS149C, LYS207A, LYS207C, PHE209A, PHE209C, PRO113A, PRO113C, PRO204A, PRO204C, SER116A, SER153A, SER153C, SER191A, SER191C, SER201A, SER201C, SER203A, SER203C, SER208A, SER208C, THR114A, THR114C, THR193A, THR193C, THR197C, THR200C, THR202A, THR202C, TYR186C, TYR192A, TYR192C, VAL115A, VAL115C, VAL206A, VAL206C
• A-D: ALA129D, ALA130D, ASN210A, ILE117A, LYS207A, PHE118A, PHE209A, PRO119A, SER116A, SER128D, SER208A, VAL206A
• B-C: ALA129B, ALA130B, ASN210C, GLN131B, LYS207C, PHE209C, SER128B, SER208C
• B-D: ALA125B, ALA129B, ALA129D, ALA130B, ALA130D, ARG199B, ARG199D, ASN133B, ASN133D, GLN131B, GLN131D, GLY127B, GLY127D, PRO126B, PRO126D, PRO200B, PRO200D, SER128B, SER128D, SER136B, SER195D, SER202D, THR132B, THR132D, VAL138B, VAL138D, VAL226B
• C-D: ALA125D, ALA129D, ALA130C, ALA130D, ALA176D, ALA94C, ARG199D, ARG94D, ASN133D, ASN137C, ASN138C, ASN161C, ASN210C, ASN28C, ASN30C, ASN37D, ASN53C, ASN60D, ASP101D, ASP165C, ASP167C, ASP170C, ASP1C, ASP98D, ASP99D, CYS134C, CYS142D, CYS88C, CYS92D, GLN105D, GLN124C, GLN179D, GLN38C, GLN39D, GLN3D, GLN42C, GLN6D, GLN90C, GLU123C, GLU1D, GLU34C, GLU46D, GLY100C, GLY101C, GLY104D, GLY106D, GLY127D, GLY128C, GLY129C, GLY141D, GLY146D, GLY158C, GLY169D, GLY41C, GLY42D, GLY49D, GLY57C, GLY58D, GLY91C, GLY93D, GLY99C, HIS172D, HIS27C, HIS35D, HIS41D, HIS61D, HIS93C, ILE117C, ILE223D, ILE48C, ILE48D, LEU124D, LEU125C, LEU136C, LEU140D, LEU143D, LEU160C, LEU178D, LEU179C, LEU181C, LEU184D, LEU187D, LEU33C, LEU45D, LEU46C, LEU4D, LEU9C, LYS103C, LYS142C, LYS145D, LYS169C, LYS207C, LYS221D, LYS222D, LYS38D, LYS39C, LYS43D, LYS45C, LYS50C, LYS62D, MET137D, MET175C, PHE100D, PHE118C, PHE135C, PHE139C, PHE174D, PHE209C, PHE55C, PHE63D, PHE89C, PHE98C, PRO119C, PRO120C, PRO123D, PRO126D, PRO175D, PRO40C, PRO44C, PRO95C, SER116C, SER120D, SER121C, SER122C, SER127C, SER128D, SER131C, SER162C, SER167D, SER168D, SER174C, SER176C, SER177C, SER180D, SER188D, SER189D, SER190D, SER208C, SER27C, SER43C, SER44D, SER56C, SER95D, THR102C, THR114C, THR126C, THR132D, THR139D, THR164C, THR172C, THR173D, THR178C, THR180C, THR186D, THR192D, THR31C, THR96D, THR97C, TRP103D, TRP157D, TRP163C, TRP36D, TRP47D, TRP97D, TYR102D, TYR122D, TYR173C, TYR185D, TYR32C, TYR36C, TYR49C, TYR50D, TYR59D, TYR87C, TYR91D, TYR96C, VAL115C, VAL121D, VAL132C, VAL133C, VAL138D, VAL144D, VAL159C, VAL171D, VAL177D, VAL191D, VAL206C, VAL226D, VAL2D, VAL51C, VAL85C, VAL89D