3I4J

crystal structure of aminotransferase, class iii from deinococcus radiodurans

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 294
  • Norm. En. per Res.: -4.5122
• 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	-0.3519	-0.3519	8	0	0	76	0	9	5
A-C	-250.1977	87.1212	-1163.52	-1326.5964	294	42	40	41704	0	34	49
A-D	-12.4071	-47.3918	-32.1393	-91.9382	40	6	0	1778	2	16	14
B-C	0.0	0.0	-0.0815	-0.0815	3	0	0	17	0	0	0
B-D	-257.4065	96.4279	-1162.5	-1323.4786	296	48	40	41769	0	34	48
C-D	0.0	0.0	-0.2929	-0.2929	8	0	0	64	0	9	4

Interface residues

• A-B: ARG374A, ARG83B, ASP427A, ASP72B, GLU75B, LYS381A, SER70B, THR89B
• A-C: ALA105A, ALA105C, ALA15A, ALA15C, ALA264A, ALA264C, ALA265A, ALA265C, ALA268A, ALA268C, ALA271A, ALA271C, ALA275A, ALA275C, ALA276A, ALA276C, ALA289A, ALA297A, ALA297C, ALA305A, ALA305C, ALA38A, ALA38C, ALA41A, ALA41C, ALA48A, ALA48C, ALA55A, ALA55C, ALA56A, ALA56C, ALA58A, ALA58C, ALA59A, ALA59C, ALA78A, ALA78C, ALA82A, ALA82C, ALA94A, ALA94C, ARG156A, ARG17A, ARG17C, ARG29A, ARG29C, ARG30A, ARG30C, ARG47A, ARG47C, ARG53A, ARG53C, ARG60A, ARG60C, ARG7A, ARG7C, ARG80A, ARG80C, ARG83A, ARG83C, ARG91A, ARG91C, ASN3A, ASN3C, ASN42C, ASP25A, ASP25C, ASP26A, ASP26C, ASP33A, ASP33C, ASP72A, ASP72C, GLN111A, GLN111C, GLN57A, GLN57C, GLN68A, GLN68C, GLU100A, GLU100C, GLU19A, GLU19C, GLU281A, GLU281C, GLU49A, GLU49C, GLU52A, GLU52C, GLU75A, GLU75C, GLU76A, GLU76C, GLY18A, GLY18C, GLY20A, GLY20C, GLY260A, GLY260C, GLY262A, GLY262C, GLY266A, GLY266C, GLY285A, GLY285C, GLY286A, GLY286C, GLY288A, GLY293A, GLY293C, GLY298A, GLY298C, GLY34A, GLY34C, GLY37A, GLY37C, GLY383A, GLY383C, GLY44A, GLY44C, GLY46A, GLY46C, GLY51A, GLY51C, GLY66A, GLY66C, GLY79A, GLY79C, GLY97A, GLY97C, GLY98A, GLY98C, HIS292A, HIS292C, HIS299A, HIS299C, HIS45A, HIS45C, HIS65A, HIS65C, ILE256A, ILE256C, ILE385A, ILE385C, ILE43A, ILE43C, LEU108A, LEU108C, LEU23A, LEU23C, LEU263A, LEU263C, LEU270A, LEU270C, LEU273A, LEU273C, LEU274A, LEU274C, LEU32A, LEU32C, LEU380A, LEU380C, LEU384A, LEU384C, LEU39A, LEU39C, LEU61A, LEU61C, LEU74A, LEU74C, LEU81A, LEU81C, LEU87A, LEU87C, LYS107C, LYS10A, LYS10C, LYS261A, LYS261C, MET155C, MET234A, MET284A, MET284C, MET291A, MET291C, MET54A, MET54C, PHE22A, PHE22C, PHE290A, PHE290C, PHE294A, PHE294C, PHE5A, PHE5C, PHE63A, PHE63C, PHE69A, PHE69C, PHE90A, PHE90C, PHE92A, PHE92C, PRO11A, PRO11C, PRO13A, PRO13C, PRO157A, PRO269A, PRO269C, PRO277A, PRO277C, PRO300A, PRO300C, PRO62A, PRO62C, PRO88A, PRO88C, SER104C, SER287A, SER302A, SER302C, SER35A, SER35C, SER36A, SER36C, SER67A, SER67C, SER70A, SER70C, SER71A, SER71C, SER8A, SER8C, SER96A, SER96C, SER99A, SER99C, SER9A, SER9C, THR295A, THR295C, THR386A, THR386C, THR89A, THR89C, TRP93A, TRP93C, TYR12A, TYR12C, TYR24A, TYR24C, TYR267A, TYR267C, TYR280A, TYR280C, TYR296A, TYR296C, TYR31A, TYR31C, TYR387A, TYR387C, TYR6A, TYR6C, TYR77A, TYR77C, VAL14A, VAL14C, VAL16A, VAL16C, VAL233A, VAL233C, VAL279A, VAL279C, VAL283A, VAL283C, VAL301A, VAL301C, VAL303A, VAL303C, VAL309A, VAL309C, VAL40A, VAL40C, VAL4A, VAL4C, VAL50A, VAL50C, VAL64A, VAL64C, VAL73A, VAL73C, VAL95A, VAL95C
• A-D: ALA15A, ALA15D, ALA27A, ALA27D, ARG29A, ARG29D, ARG30A, ARG30D, ARG382A, ARG382D, ASP25A, ASP25D, ASP26A, ASP26D, GLY28A, GLY28D, GLY383A, GLY383D, LEU380A, LEU380D, LYS10A, LYS10D, LYS381A, LYS381D, PRO11A, PRO11D, PRO13A, PRO13D, SER9A, SER9D, TYR12A, TYR12D, TYR31A, TYR31D, TYR6A, TYR6D, VAL14A, VAL14D, VAL16A, VAL16D
• B-C: GLY285B, GLY286B, GLY286C
• B-D: ALA105B, ALA105D, ALA15B, ALA15D, ALA264B, ALA264D, ALA265B, ALA265D, ALA268B, ALA268D, ALA271B, ALA271D, ALA275B, ALA275D, ALA276B, ALA276D, ALA289D, ALA297B, ALA297D, ALA304B, ALA305B, ALA305D, ALA38B, ALA38D, ALA41B, ALA41D, ALA48B, ALA48D, ALA55B, ALA55D, ALA56B, ALA56D, ALA58B, ALA58D, ALA59B, ALA59D, ALA78B, ALA78D, ALA82B, ALA82D, ALA94B, ALA94D, ARG156D, ARG17B, ARG17D, ARG29B, ARG29D, ARG30B, ARG30D, ARG47B, ARG47D, ARG53B, ARG53D, ARG60B, ARG60D, ARG7B, ARG7D, ARG80B, ARG80D, ARG83B, ARG83D, ARG91B, ARG91D, ASN3B, ASN3D, ASN42B, ASN42D, ASP25B, ASP25D, ASP26B, ASP26D, ASP33B, ASP33D, ASP72B, ASP72D, GLN111B, GLN111D, GLN57B, GLN57D, GLN68B, GLN68D, GLU100B, GLU100D, GLU19B, GLU19D, GLU281B, GLU281D, GLU49B, GLU49D, GLU52B, GLU52D, GLU75B, GLU75D, GLU76B, GLU76D, GLY18B, GLY18D, GLY20B, GLY20D, GLY260B, GLY260D, GLY262B, GLY262D, GLY266B, GLY266D, GLY285B, GLY285D, GLY286B, GLY286D, GLY288D, GLY293B, GLY293D, GLY298B, GLY298D, GLY34B, GLY34D, GLY37B, GLY37D, GLY383B, GLY383D, GLY44B, GLY44D, GLY46B, GLY46D, GLY51B, GLY51D, GLY66B, GLY66D, GLY79B, GLY79D, GLY97B, GLY97D, GLY98B, GLY98D, HIS292B, HIS292D, HIS299B, HIS299D, HIS45B, HIS45D, HIS65B, HIS65D, ILE256B, ILE256D, ILE385B, ILE385D, ILE43B, ILE43D, LEU108B, LEU108D, LEU23B, LEU23D, LEU263B, LEU263D, LEU270B, LEU270D, LEU273B, LEU273D, LEU274B, LEU274D, LEU32B, LEU32D, LEU380B, LEU380D, LEU384B, LEU384D, LEU39B, LEU39D, LEU61B, LEU61D, LEU74B, LEU74D, LEU81B, LEU81D, LEU87B, LEU87D, LYS107B, LYS10B, LYS10D, LYS261B, LYS261D, MET155B, MET234B, MET284B, MET284D, MET291B, MET291D, MET54B, MET54D, PHE22B, PHE22D, PHE290B, PHE290D, PHE294B, PHE294D, PHE5B, PHE5D, PHE63B, PHE63D, PHE69B, PHE69D, PHE90B, PHE90D, PHE92B, PHE92D, PRO11B, PRO11D, PRO13B, PRO13D, PRO157D, PRO269B, PRO269D, PRO277B, PRO277D, PRO300B, PRO300D, PRO62B, PRO62D, PRO88B, PRO88D, SER104B, SER287D, SER302B, SER302D, SER35B, SER35D, SER36B, SER36D, SER67B, SER67D, SER70B, SER70D, SER71B, SER71D, SER8B, SER8D, SER96B, SER96D, SER99B, SER99D, SER9B, SER9D, THR295B, THR295D, THR386B, THR386D, THR89B, THR89D, TRP93B, TRP93D, TYR12B, TYR12D, TYR24B, TYR24D, TYR267B, TYR267D, TYR280B, TYR280D, TYR296B, TYR296D, TYR31B, TYR31D, TYR387B, TYR387D, TYR6B, TYR6D, TYR77B, TYR77D, VAL14B, VAL14D, VAL16B, VAL16D, VAL233B, VAL233D, VAL279B, VAL279D, VAL283B, VAL283D, VAL301B, VAL301D, VAL303B, VAL303D, VAL309B, VAL309D, VAL40B, VAL40D, VAL4B, VAL4D, VAL50B, VAL50D, VAL64B, VAL64D, VAL73B, VAL73D, VAL95B, VAL95D
• C-D: ARG374D, ARG83C, ASP427D, ASP72C, GLU75C, LYS381D, SER70C, THR89C