3A6P

crystal structure of exportin-5:rangtp:pre-mirna complex

• Total interactions analyzed: 45
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 204
  • Norm. En. per Res.: -2.6533
• 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	-52.8979	-52.8979	35	0	0	3040	0	0	0
A-C	-51.6758	-156.8674	-332.724	-541.2672	204	20	5	15167	16	102	85
A-F	-5.8229	17.8578	-101.177	-89.142	90	9	0	5723	2	19	23
F-G	0.0	0.0	-48.4062	-48.4062	35	1	0	3042	0	0	0
F-H	-46.8659	-133.6996	-284.28	-464.8455	181	21	4	13410	17	90	78

Interface residues

• A-B: ALA1097A, GLN1122A, GLN1128A, GLU1102A, GLU1120A, HIS1095A, ILE1118A, ILE1121A, LEU1077A, LEU1080A, LEU1126A, LEU1133A, LYS1132A, MET1090A, MET1115A, PHE1073A, PHE1098A, PHE1129A, PRO1119A, SER1125A, TYR1101A, UNK1305B, UNK1306B, UNK1307B, UNK1308B, UNK1309B, UNK1310B, UNK1311B, UNK1312B, UNK1313B, UNK1314B, UNK1315B, UNK1316B, UNK1317B, VAL1094A
• A-C: ALA115A, ALA161A, ALA16A, ALA232A, ALA33A, ALA41C, ALA61A, ALA67C, ALA83C, ARG106C, ARG110C, ARG118A, ARG129C, ARG140C, ARG159A, ARG166C, ARG222A, ARG28A, ARG30A, ARG321A, ARG423A, ARG64A, ARG76C, ARG937A, ARG95C, ARG963A, ASN100C, ASN103C, ASN110A, ASN114C, ASN143C, ASN156C, ASN173C, ASN229A, ASN24A, ASN62C, ASN935A, ASP107C, ASP1087A, ASP114A, ASP125C, ASP128C, ASP163A, ASP171C, ASP22A, ASP236A, ASP425A, ASP427A, ASP431A, ASP65C, ASP77C, CYS112C, CYS37A, CYS419A, GLN1085A, GLN10C, GLN145C, GLN168A, GLN27A, GLN324A, GLN69A, GLN82C, GLN936A, GLU109A, GLU113C, GLU151A, GLU162A, GLU175C, GLU269A, GLU313A, GLU38A, GLU420A, GLU42A, GLU430A, GLU46C, GLU70C, GLU72A, GLU952A, GLU955A, GLU959A, GLY1084A, GLY170C, GLY233A, GLY44C, GLY67A, GLY73C, GLY74C, GLY78C, HIS105C, HIS1083A, HIS1086A, HIS111A, HIS48C, HIS65A, HIS73A, ILE112A, ILE126C, ILE156A, ILE273A, ILE62A, ILE70A, ILE81C, ILE934A, LEU1042A, LEU108C, LEU144C, LEU158A, LEU160A, LEU162C, LEU174C, LEU265A, LEU272A, LEU311A, LEU31A, LEU34A, LEU43C, LEU75C, LEU816A, LYS1039A, LYS113A, LYS125A, LYS127C, LYS12C, LYS130C, LYS132C, LYS134C, LYS141C, LYS142C, LYS152C, LYS159C, LYS167C, LYS314A, LYS320A, LYS35A, LYS413A, LYS41A, LYS60C, LYS71C, LYS76A, LYS99C, MET154A, MET20A, MET21A, MET956A, PHE138C, PHE155A, PHE167A, PHE366A, PHE424A, PHE426A, PHE435A, PHE66A, PHE72C, PHE77A, PRO102C, PRO116C, PRO172C, PRO23A, PRO411A, PRO49C, PRO817A, SER117A, SER153C, SER25A, SER276A, SER412A, SER422A, SER428A, THR1041A, THR166A, THR169A, THR18A, THR230A, THR26A, THR42C, THR66C, THR93C, TRP104C, TRP163C, TRP64C, TRP931A, TYR146C, TYR147C, TYR155C, TYR421A, TYR79C, TYR80C, VAL101C, VAL109C, VAL111C, VAL121A, VAL164A, VAL165A, VAL17A, VAL19A, VAL225A, VAL317A, VAL40C, VAL45C, VAL47C, VAL60A, VAL63A, VAL63C, VAL933A
• A-F: ARG566A, ARG566F, ASN540A, ASN540F, ASN622A, ASN622F, ASN628A, ASN628F, ASN636A, ASN636F, ASP542A, ASP542F, ASP624A, ASP624F, GLN536A, GLN536F, GLN572A, GLN572F, GLN632A, GLN632F, GLU568A, GLU568F, GLU584F, GLU588A, GLU588F, GLU637A, GLU637F, GLU671A, GLU671F, HIS629A, HIS629F, ILE532A, ILE532F, LEU539A, LEU539F, LEU570A, LEU570F, LEU626A, LEU626F, LEU633A, LEU633F, LEU634A, LEU634F, LEU638F, LEU639A, LEU639F, LEU640A, LEU640F, LYS544F, LYS576A, LYS576F, LYS631A, LYS631F, MET625A, MET625F, PHE569A, PHE569F, PHE574A, PHE574F, PHE578A, PHE578F, PHE583A, PHE583F, PHE623A, PRO567A, PRO567F, PRO571A, PRO571F, PRO621A, PRO621F, SER575A, SER575F, SER579A, SER579F, SER580A, SER580F, SER635A, SER635F, THR543A, THR543F, THR582A, THR582F, THR585A, THR585F, TYR627A, TYR627F, VAL573A, VAL573F, VAL581A, VAL630F
• F-G: ALA1097F, GLN1122F, GLN1128F, GLU1102F, GLU1120F, HIS1095F, ILE1118F, ILE1121F, LEU1077F, LEU1080F, LEU1126F, LEU1133F, LYS1132F, MET1090F, MET1115F, PHE1073F, PHE1098F, PHE1129F, PRO1119F, SER1125F, TYR1101F, UNK1305G, UNK1306G, UNK1307G, UNK1308G, UNK1309G, UNK1310G, UNK1311G, UNK1312G, UNK1313G, UNK1314G, UNK1315G, UNK1316G, UNK1317G, VAL1094F
• F-H: ALA115F, ALA161F, ALA16F, ALA232F, ALA33F, ALA61F, ALA67H, ALA83H, ARG106H, ARG110H, ARG118F, ARG129H, ARG140H, ARG159F, ARG166H, ARG222F, ARG30F, ARG321F, ARG423F, ARG64F, ARG76H, ARG937F, ARG95H, ARG963F, ASN100H, ASN103H, ASN110F, ASN114H, ASN143H, ASN156H, ASN173H, ASN229F, ASN24F, ASN62H, ASP107H, ASP1087F, ASP114F, ASP128H, ASP163F, ASP171H, ASP22F, ASP425F, ASP427F, ASP429F, ASP431F, ASP77H, CYS112H, CYS37F, GLN1085F, GLN10H, GLN145H, GLN168F, GLN27F, GLN324F, GLN69F, GLN82H, GLU109F, GLU113H, GLU122F, GLU151F, GLU162F, GLU175H, GLU269F, GLU313F, GLU38F, GLU420F, GLU42F, GLU430F, GLU46H, GLU70H, GLU72F, GLU952F, GLU959F, GLY1088F, GLY170H, GLY233F, GLY44H, GLY67F, GLY73H, GLY74H, GLY78H, HIS105H, HIS1086F, HIS111F, HIS48H, HIS65F, HIS73F, ILE112F, ILE156F, ILE273F, ILE62F, ILE70F, ILE81H, ILE934F, LEU108H, LEU158F, LEU160F, LEU162H, LEU174H, LEU265F, LEU272F, LEU311F, LEU31F, LEU34F, LEU43H, LEU75H, LYS1039F, LYS113F, LYS125F, LYS127H, LYS12H, LYS130H, LYS132H, LYS141H, LYS142H, LYS152H, LYS159H, LYS167H, LYS320F, LYS35F, LYS413F, LYS41F, LYS60H, LYS71H, LYS76F, LYS99H, MET1082F, MET154F, MET20F, MET21F, MET956F, PHE138H, PHE155F, PHE167F, PHE366F, PHE424F, PHE426F, PHE435F, PHE66F, PHE72H, PHE77F, PRO102H, PRO172H, PRO23F, PRO411F, PRO49H, SER117F, SER25F, SER412F, SER422F, SER428F, THR1041F, THR166F, THR169F, THR18F, THR230F, THR414F, THR42H, THR93H, TRP104H, TRP163H, TRP64H, TRP931F, TYR146H, TYR147H, TYR79H, TYR80H, VAL101H, VAL109H, VAL111H, VAL121F, VAL164F, VAL165F, VAL17F, VAL19F, VAL225F, VAL317F, VAL45H, VAL47H, VAL60F, VAL63F