3RWT

crystal structure of circular permutated red fluorescent protein mkate(cp 154-153)

• Total interactions analyzed: 28
• Total true interactions: 13
• Strongest Interaction:
  • Chains: B-F
  • Int. Res.: 147
  • Norm. En. per Res.: -3.5086
• Hub Node: C(4)

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	2.4011	-10.3355	-7.9344	17	0	0	488	0	2	4
A-F	-4.5414	10.8241	-189.569	-183.2863	99	11	4	9609	0	24	29
A-G	-45.7401	-98.1738	-324.513	-468.4269	147	26	9	15475	7	68	70
B-F	-69.3358	-97.0988	-349.336	-515.7706	147	28	10	15680	8	68	72
B-G	-8.9765	11.1643	-189.782	-187.5941	101	7	4	9765	0	23	29
C-D	-7.0745	11.178	-187.64	-183.5365	99	8	4	9544	0	24	30
C-E	-56.6737	-98.2898	-334.711	-489.6745	147	29	10	15651	9	68	72
C-F	0.0	-13.6148	-26.1159	-39.7307	41	1	0	1042	4	30	25
C-H	0.0	2.3003	-7.3401	-5.0397	17	0	0	408	0	2	4
D-E	0.0	3.377	-9.9165	-6.5395	17	0	0	483	0	2	4
D-H	-50.4317	-100.7605	-321.263	-472.4552	149	28	8	15567	8	68	70
E-H	-8.6758	13.6509	-194.176	-189.201	101	7	4	9796	0	22	29
F-G	0.0	2.2687	-7.2741	-5.0054	16	0	0	398	0	2	4

Interface residues

• A-B: ASN210A, ASN210B, ASP183A, ASP183B, GLU182A, GLU182B, GLY184A, GLY184B, GLY185A, GLY185B, ILE19A, LEU18A, LEU18B, PRO212A, PRO212B, TYR181A, TYR181B
• A-F: ALA189A, ALA189F, ALA235A, ALA235F, ARG177A, ARG177F, ARG207A, ARG207F, ARG27A, ARG27F, ARG5A, ARG5F, ASN105A, ASN105F, ASN106A, ASN106F, ASN210A, ASN210F, ASN214A, ASN214F, ASN21A, ASP236A, ASP236F, GLN191A, GLN191F, GLU0A, GLU101A, GLU101F, GLU176A, GLU176F, GLU3A, GLU3F, GLY102A, GLY102F, GLY184A, GLY184F, GLY185A, GLY185F, GLY208A, GLY208F, GLY4A, GLY4F, HIS107A, HIS107F, HIS108A, HIS108F, ILE206A, ILE206F, LEU187A, LEU187F, LEU22A, LYS205A, LYS205F, LYS23A, LYS23F, LYS29A, LYS29F, MET218A, MET218F, PHE1A, PHE1F, PHE211A, PHE211F, PRO212A, PRO212F, SER213A, SER213F, SER28A, SER28F, THR103A, THR103F, THR174A, THR174F, THR179A, THR179F, THR180A, THR180F, THR188A, THR188F, THR190A, THR190F, THR24A, THR24F, THR25A, THR25F, TRP175A, TRP175F, TYR233A, TYR233F, VAL104A, VAL104F, VAL178A, VAL178F, VAL186A, VAL186F, VAL204A, VAL204F, VAL209A, VAL209F
• A-G: ALA227A, ALA227G, ALA235A, ALA235G, ALA65A, ALA65G, ALA67A, ALA67G, ALA9A, ALA9G, ARG45A, ARG45G, ARG46A, ARG46G, ARG49A, ARG49G, ARG5A, ARG5G, ARG68A, ARG68G, ASN156A, ASN156G, ASN21A, ASN21G, ASP236A, ASP236G, ASP44A, ASP44G, ASP71A, ASP71G, ASP7A, ASP7G, CYS20A, CYS20G, CYS70A, CYS70G, GLN124A, GLN124G, GLN61A, GLN61G, GLU121G, GLU182A, GLU182G, GLU226A, GLU226G, GLU230A, GLU230G, GLU3A, GLU3G, GLU48A, GLU48G, GLU63A, GLU63G, GLY122A, GLY122G, GLY15A, GLY15G, GLY16A, GLY16G, GLY224A, GLY224G, GLY39A, GLY39G, GLY4A, GLY4G, GLY77A, GLY77G, GLY80A, GLY80G, GLY81A, HIS17A, HIS17G, HIS62A, HIS62G, HIS78A, HIS78G, ILE19A, ILE19G, ILE50A, ILE50G, LEU10A, LEU10G, LEU18A, LEU18G, LEU22A, LEU22G, LEU232A, LEU232G, LEU47A, LEU47G, LEU72A, LEU72G, LEU76A, LEU76G, LYS118G, LYS11A, LYS11G, LYS23A, LYS23G, LYS51G, LYS75A, LYS75G, LYS79A, LYS79G, MET231A, MET231G, MET8A, MET8G, PRO234A, PRO234G, PRO73A, PRO73G, SER228A, SER228G, SER6A, SER6G, SER74A, SER74G, THR123A, THR123G, THR125A, THR125G, THR180A, THR180G, THR229A, THR229G, THR24G, TRP225A, TRP225G, TYR181A, TYR181G, TYR233A, TYR233G, TYR41A, TYR41G, TYR42A, TYR42G, TYR69A, TYR69G, VAL40A, VAL40G, VAL43A, VAL43G, VAL64A, VAL64G, VAL66A, VAL66G
• B-F: ALA227B, ALA227F, ALA235B, ALA235F, ALA65B, ALA65F, ALA67B, ALA67F, ALA9B, ALA9F, ARG45B, ARG45F, ARG46B, ARG46F, ARG49B, ARG49F, ARG5B, ARG5F, ARG68B, ARG68F, ASN156B, ASN156F, ASN21B, ASN21F, ASP236B, ASP236F, ASP44B, ASP44F, ASP71B, ASP71F, ASP7B, ASP7F, CYS20B, CYS20F, CYS70B, CYS70F, GLN124B, GLN124F, GLN61B, GLN61F, GLU182B, GLU182F, GLU226B, GLU226F, GLU230B, GLU230F, GLU3B, GLU3F, GLU48B, GLU48F, GLU63B, GLU63F, GLY122B, GLY122F, GLY15B, GLY15F, GLY16B, GLY16F, GLY224B, GLY224F, GLY39B, GLY39F, GLY4B, GLY4F, GLY77B, GLY77F, GLY80B, GLY80F, GLY81B, HIS17B, HIS17F, HIS62B, HIS62F, HIS78B, HIS78F, ILE19B, ILE19F, ILE50B, ILE50F, LEU10B, LEU10F, LEU18B, LEU18F, LEU223F, LEU22B, LEU22F, LEU232B, LEU232F, LEU47B, LEU47F, LEU72B, LEU72F, LEU76B, LEU76F, LYS118F, LYS11B, LYS11F, LYS23B, LYS23F, LYS51B, LYS51F, LYS75B, LYS75F, LYS79B, LYS79F, MET231B, MET231F, MET8B, MET8F, PRO234B, PRO234F, PRO73B, PRO73F, SER228B, SER228F, SER6B, SER6F, SER74B, SER74F, THR123B, THR123F, THR125B, THR125F, THR180B, THR180F, THR229B, THR229F, TRP225B, TRP225F, TYR181B, TYR181F, TYR233B, TYR233F, TYR41B, TYR41F, TYR42B, TYR42F, TYR69B, TYR69F, VAL40B, VAL40F, VAL43B, VAL43F, VAL64B, VAL64F, VAL66B, VAL66F
• B-G: ALA189B, ALA189G, ALA235B, ALA235G, ARG177B, ARG177G, ARG207B, ARG207G, ARG27B, ARG27G, ARG5B, ARG5G, ASN105B, ASN105G, ASN106B, ASN106G, ASN210B, ASN210G, ASN214B, ASN214G, ASN21G, ASP183G, ASP192B, ASP192G, ASP236B, ASP236G, GLN191B, GLN191G, GLU0B, GLU101B, GLU101G, GLU176B, GLU176G, GLU3B, GLU3G, GLY102B, GLY102G, GLY184B, GLY184G, GLY185B, GLY185G, GLY208B, GLY208G, GLY4B, HIS107B, HIS107G, HIS108B, HIS108G, ILE206B, ILE206G, LEU187B, LEU187G, LYS205B, LYS205G, LYS23B, LYS23G, LYS29B, LYS29G, MET218B, MET218G, PHE173B, PHE1B, PHE1G, PHE211B, PHE211G, PRO212B, PRO212G, SER213B, SER213G, SER28B, SER28G, THR103B, THR103G, THR174B, THR174G, THR179B, THR179G, THR180B, THR180G, THR188B, THR188G, THR190B, THR190G, THR24B, THR24G, THR25B, THR25G, TRP175B, TRP175G, TYR181G, TYR233G, VAL104B, VAL104G, VAL178B, VAL178G, VAL186B, VAL186G, VAL204B, VAL204G, VAL209B, VAL209G
• C-D: ALA189C, ALA189D, ALA235C, ALA235D, ARG177C, ARG177D, ARG207C, ARG207D, ARG27C, ARG27D, ARG5C, ARG5D, ASN105C, ASN105D, ASN106C, ASN106D, ASN210C, ASN210D, ASN214C, ASN214D, ASP192C, ASP192D, ASP236C, ASP236D, GLN191C, GLN191D, GLU0C, GLU101C, GLU101D, GLU176C, GLU176D, GLU3C, GLU3D, GLY102C, GLY102D, GLY184C, GLY184D, GLY185C, GLY185D, GLY208C, GLY208D, GLY4C, GLY4D, HIS107C, HIS107D, HIS108C, HIS108D, ILE206C, ILE206D, LEU187C, LEU187D, LYS205C, LYS205D, LYS23C, LYS23D, LYS29C, LYS29D, MET218C, MET218D, PHE1C, PHE1D, PHE211C, PHE211D, PRO212C, PRO212D, SER213C, SER213D, SER28C, SER28D, THR103C, THR103D, THR174C, THR174D, THR179C, THR179D, THR180C, THR180D, THR188C, THR188D, THR190C, THR190D, THR24C, THR24D, THR25C, THR25D, TRP175C, TRP175D, TYR233C, TYR233D, VAL104C, VAL104D, VAL178C, VAL178D, VAL186C, VAL186D, VAL204C, VAL204D, VAL209C, VAL209D
• C-E: ALA227C, ALA227E, ALA235C, ALA235E, ALA65C, ALA65E, ALA67C, ALA67E, ALA9C, ALA9E, ARG45C, ARG45E, ARG46C, ARG46E, ARG49C, ARG49E, ARG5C, ARG5E, ARG68C, ARG68E, ASN156C, ASN156E, ASN21C, ASN21E, ASP236C, ASP236E, ASP44C, ASP44E, ASP71C, ASP71E, ASP7C, ASP7E, CYS20C, CYS20E, CYS70C, CYS70E, GLN124C, GLN124E, GLN61C, GLN61E, GLU182C, GLU182E, GLU226C, GLU226E, GLU230C, GLU230E, GLU3C, GLU3E, GLU48C, GLU48E, GLU63C, GLU63E, GLY122C, GLY122E, GLY15C, GLY15E, GLY16C, GLY16E, GLY224C, GLY224E, GLY39C, GLY39E, GLY4C, GLY4E, GLY77C, GLY77E, GLY80C, GLY80E, GLY81C, GLY81E, HIS17C, HIS17E, HIS62C, HIS62E, HIS78C, HIS78E, ILE19C, ILE19E, ILE50C, ILE50E, LEU10C, LEU10E, LEU18C, LEU18E, LEU223C, LEU22C, LEU22E, LEU232C, LEU232E, LEU47C, LEU47E, LEU72C, LEU72E, LEU76C, LEU76E, LYS11C, LYS11E, LYS23C, LYS23E, LYS51C, LYS51E, LYS75C, LYS75E, LYS79C, LYS79E, MET231C, MET231E, MET8C, MET8E, PRO234C, PRO234E, PRO73C, PRO73E, SER228C, SER228E, SER6C, SER6E, SER74C, SER74E, THR123C, THR123E, THR125C, THR125E, THR180C, THR180E, THR229C, THR229E, TRP225C, TRP225E, TYR181C, TYR181E, TYR233C, TYR233E, TYR41C, TYR41E, TYR42C, TYR42E, TYR69C, TYR69E, VAL40C, VAL40E, VAL43C, VAL43E, VAL64C, VAL64E, VAL66C, VAL66E
• C-F: ARG127C, ARG127F, ASN93C, ASN93F, ASP197C, ASP197F, CYS199C, CYS199F, GLU114C, GLU114F, GLU116C, GLU116F, GLU121C, GLU121F, GLU60C, GLU60F, GLY115C, GLY115F, GLY117C, GLY198C, GLY198F, HIS95C, HIS95F, LYS118C, LYS118F, LYS129C, LYS129F, LYS51C, LYS51F, LYS97C, LYS97F, MET94C, MET94F, MET96C, MET96F, THR125C, THR125F, THR91C, THR91F, TYR58C, TYR58F
• C-H: ASN210C, ASN210H, ASP183C, ASP183H, GLU182C, GLU182H, GLY184C, GLY184H, GLY185C, GLY185H, ILE19C, LEU18C, LEU18H, PRO212C, PRO212H, TYR181C, TYR181H
• D-E: ASN210D, ASN210E, ASP183D, ASP183E, GLU182D, GLU182E, GLY184D, GLY184E, GLY185D, GLY185E, ILE19D, LEU18D, LEU18E, PRO212D, PRO212E, TYR181D, TYR181E
• D-H: ALA227D, ALA227H, ALA235D, ALA235H, ALA65D, ALA65H, ALA67D, ALA67H, ALA9D, ALA9H, ARG45D, ARG45H, ARG46D, ARG46H, ARG49D, ARG49H, ARG5D, ARG5H, ARG68D, ARG68H, ASN156D, ASN156H, ASN21D, ASN21H, ASP236D, ASP236H, ASP44D, ASP44H, ASP71D, ASP71H, ASP7D, ASP7H, CYS20D, CYS20H, CYS70D, CYS70H, GLN124D, GLN124H, GLN61D, GLN61H, GLU121H, GLU182D, GLU182H, GLU226D, GLU226H, GLU230D, GLU230H, GLU3D, GLU3H, GLU48D, GLU48H, GLU63D, GLU63H, GLY122D, GLY122H, GLY15D, GLY15H, GLY16D, GLY16H, GLY224D, GLY224H, GLY39D, GLY39H, GLY4D, GLY4H, GLY77D, GLY77H, GLY80D, GLY80H, GLY81D, GLY81H, HIS17D, HIS17H, HIS62D, HIS62H, HIS78D, HIS78H, ILE19D, ILE19H, ILE50D, ILE50H, LEU10D, LEU10H, LEU18D, LEU18H, LEU223H, LEU22D, LEU22H, LEU232D, LEU232H, LEU47D, LEU47H, LEU72D, LEU72H, LEU76D, LEU76H, LYS118H, LYS11D, LYS11H, LYS23D, LYS23H, LYS51H, LYS75D, LYS75H, LYS79D, LYS79H, MET231D, MET231H, MET8D, MET8H, PRO234D, PRO234H, PRO73D, PRO73H, SER228D, SER228H, SER6D, SER6H, SER74D, SER74H, THR123D, THR123H, THR125D, THR125H, THR180D, THR180H, THR229D, THR229H, THR24H, TRP225D, TRP225H, TYR181D, TYR181H, TYR233D, TYR233H, TYR41D, TYR41H, TYR42D, TYR42H, TYR69D, TYR69H, VAL40D, VAL40H, VAL43D, VAL43H, VAL64D, VAL64H, VAL66D, VAL66H
• E-H: ALA189E, ALA189H, ALA235E, ALA235H, ARG177E, ARG177H, ARG207E, ARG207H, ARG27E, ARG27H, ARG5E, ARG5H, ASN105E, ASN105H, ASN106E, ASN106H, ASN210E, ASN210H, ASN214E, ASN214H, ASN21H, ASP183H, ASP192E, ASP236E, ASP236H, GLN191E, GLN191H, GLU101E, GLU101H, GLU176E, GLU176H, GLU3E, GLU3H, GLY102E, GLY102H, GLY184E, GLY184H, GLY185E, GLY185H, GLY208E, GLY208H, GLY4E, HIS107E, HIS107H, HIS108E, HIS108H, ILE206E, ILE206H, LEU187E, LEU187H, LYS205E, LYS205H, LYS23E, LYS23H, LYS29E, LYS29H, MET218E, MET218H, PHE173E, PHE1E, PHE1H, PHE211E, PHE211H, PRO212E, PRO212H, SER213E, SER213H, SER28E, SER28H, THR103E, THR103H, THR174E, THR174H, THR179E, THR179H, THR180E, THR180H, THR188E, THR188H, THR190E, THR190H, THR24E, THR24H, THR25E, THR25H, TRP175E, TRP175H, TYR181E, TYR181H, TYR233E, TYR233H, VAL104E, VAL104H, VAL178E, VAL178H, VAL186E, VAL186H, VAL204E, VAL204H, VAL209E, VAL209H
• F-G: ASN210F, ASN210G, ASP183F, ASP183G, GLU182F, GLU182G, GLY184F, GLY184G, GLY185F, GLY185G, LEU18F, LEU18G, PRO212F, PRO212G, TYR181F, TYR181G