3D85

crystal structure of il-23 in complex with neutralizing fab

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 88
  • Norm. En. per Res.: -4.2926
• Hub Node: A(2)

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	-18.4919	-30.4632	-413.827	-462.7822	185	4	11	16785	2	23	22
A-C	-18.5014	-4.3192	-101.198	-124.0187	34	3	0	3259	0	5	3
B-C	-41.2702	-10.9283	-141.648	-193.8465	57	10	0	4933	2	9	5
C-D	-39.9979	-67.531	-270.221	-377.7498	88	8	6	9642	4	21	15

Interface residues

• A-B: ALA103B, ALA127B, ALA130A, ALA138B, ALA139B, ALA170B, ALA97B, ARG37A, ARG45A, ARG98B, ASN137A, ASN138A, ASN210A, ASN61B, ASN90A, ASN99B, ASP101B, ASP122A, ASP146B, ASP167A, ASP170A, ASP1A, ASP1A5, CB8.4769420.56313, CB8.75493-10.27930, CYS134A, CYS142B, CYS88A, CYS96B, GLN107B, GLN124A, GLN160A, GLN166A, GLN173B, GLN38A, GLN39B, GLN43B, GLN53A, GLN6A, GLN6B, GLN89A, GLU123A, GLU161A, GLU165A, GLU213A, GLU42A, GLU46B, GLU62B, GLY101A, GLY106B, GLY108B, GLY141B, GLY164B, GLY212A, GLY42B, GLY44B, GLY49B, GLY91A, GLY99A, HIS166B, HIS34A, HIS35B, HIS41A, HIS92A, ILE117A, ILE48A, ILE48B, ILE55A, ILE58A, LEU125A, LEU126B, LEU135A, LEU136A, LEU140B, LEU143B, LEU172B, LEU175A, LEU179A, LEU180B, LEU181A, LEU45B, LEU46A, LEU47A, LEU4B, LYS126A, LYS131B, LYS145B, LYS169A, LYS207A, LYS211B, LYS216B, LYS38B, LYS39A, LYS49A, LYS59B, LYS63B, PHE116A, PHE118A, PHE124B, PHE139A, PHE168B, PHE209A, PHE64B, PHE94A, PHE96A, PHE98A, PRO119A, PRO120A, PRO125B, PRO128B, PRO169B, PRO44A, PRO95A, SER100A, SER114A, SER121A, SER122B, SER127A, SER129B, SER130B, SER131A, SER134B, SER162A, SER163B, SER168A, SER174A, SER174B, SER176A, SER177A, SER179B, SER181B, SER182B, SER188B, SER208A, SER217B, SER40A, SER43A, SER56A, SER93A, THR129A, THR133B, THR137B, THR164A, THR167B, THR172A, THR178A, THR180A, THR185B, THR206A, THR97A, TRP100B, TRP105B, TRP36B, TRP47B, TYR104B, TYR173A, TYR192A, TYR32A, TYR36A, TYR50A, TYR50B, TYR60B, TYR86A, TYR87A, TYR95B, VAL102B, VAL115A, VAL123B, VAL132A, VAL133A, VAL144B, VAL163A, VAL165B, VAL171B, VAL183B, VAL184B, VAL186B, VAL191A, VAL209B, VAL213B, VAL33B, VAL37B, VAL3A, VAL85A, VAL93B
• A-C: ARG139C, ARG143C, ASN90A, ASP31A, ASP88C, GLN135C, GLN138C, GLN53A, GLN89A, GLU93C, GLY91A, GLY92C, HIS34A, HIS92A, ILE29A, ILE2A, LEU140C, LEU141C, LEU97C, LYS49A, PHE94A, PHE96A, PRO133C, PRO136C, PRO94C, PRO95A, SER132C, SER134C, SER30A, SER93A, SER95C, TRP137C, TYR32A, TYR50A
• B-C: ALA103B, ALA97B, ARG139C, ARG143C, ARG98B, ASN32B, ASN52B, ASN55B, ASN99B, ASP101B, ASP56B, ASP88C, GLN135C, GLU82C, GLU93C, GLY103C, GLY57B, GLY86C, GLY92C, HIS106C, HIS35B, ILE51B, ILE79C, ILE89C, LEU110C, LEU131C, LEU84C, LEU85C, LEU96C, LEU97C, LYS59B, LYS65B, LYS83C, MET34B, PHE29B, PHE90C, PRO133C, PRO136C, PRO53B, PRO94C, PRO98C, SER132C, SER134C, SER31B, SER87C, SER95C, THR28B, THR30B, THR58B, THR91C, TRP100B, TRP47B, TYR50B, TYR54B, TYR60B, VAL102B, VAL33B
• C-D: ALA152C, ALA155C, ALA157C, ALA158C, ALA162C, ALA165C, ALA166C, ALA176D, ALA179D, ALA180D, ALA25C, ARG148C, ARG159C, ARG208D, ARG291D, ARG73C, ASP209D, ASP270D, ASP290D, ASP56C, ASP59C, CYS177D, CYS22C, CYS54C, CYS58C, CYS70C, GLN144D, GLN151C, GLN15C, GLN16C, GLN19C, GLN289D, GLN53C, GLN61C, GLU181D, GLU182D, GLY164C, GLY55C, GLY57C, GLY62C, GLY77C, HIS163C, HIS244D, HIS29C, HIS51C, ILE211D, ILE52C, ILE74C, LEU147C, LEU150C, LEU184D, LEU21C, LEU249D, LEU63C, LYS145C, LYS20C, PHE153C, PHE161C, PHE206D, PHE247D, PRO178D, PRO243D, PRO50C, PRO60C, SER149C, SER175D, SER183D, SER18C, SER241D, SER245D, SER248D, SER294D, SER295D, THR167C, THR23C, THR242D, THR250D, TRP240D, TRP26C, TYR114D, TYR246D, TYR292D, TYR293D, TYR81C, VAL154C, VAL156C, VAL160C, VAL49C