3FMC

crystal structure of a putative succinylglutamate desuccinylase / aspartoacylase family protein (sama_0604) from shewanella amazonensis sb2b at 1.80 a resolution

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 167
  • Norm. En. per Res.: -3.6967
• 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	-71.8965	-12.2957	-528.051	-612.2432	166	12	6	17123	6	28	36
A-C	-87.2692	35.7696	-500.614	-552.1136	185	14	24	20272	2	56	41
A-D	-61.0467	-1.7171	-171.313	-234.0768	78	7	6	7083	0	4	5
B-C	-57.3749	-1.6565	-166.956	-225.9874	78	11	6	6821	0	4	5
B-D	-117.3701	26.829	-486.074	-576.615	181	23	25	20632	2	54	42
C-D	-87.7966	-17.6654	-511.882	-617.3441	167	17	6	17022	6	28	34

Interface residues

• A-B: ALA14A, ALA14B, ALA15A, ALA15B, ALA294A, ALA294B, ALA297A, ALA297B, ALA312A, ALA312B, ALA347A, ALA347B, ALA349A, ALA349B, ARG101A, ARG101B, ARG152A, ARG152B, ARG290A, ARG290B, ARG321A, ARG321B, ARG335A, ARG335B, ARG90A, ARG90B, ARG9A, ARG9B, ASN143A, ASN143B, ASN288A, ASN288B, ASN98A, ASN98B, ASP323A, ASP323B, ASP339A, ASP339B, ASP92A, ASP92B, GLN17A, GLN17B, GLN353A, GLN353B, GLN81A, GLN81B, GLU12A, GLU12B, GLU338A, GLU338B, GLU356A, GLU356B, GLY11A, GLY11B, GLY146A, GLY146B, GLY150A, GLY150B, GLY16A, GLY16B, GLY298A, GLY298B, GLY340A, GLY340B, GLY354A, GLY354B, GLY96A, GLY96B, HIS151A, HIS151B, HIS293A, HIS293B, HIS352A, HIS352B, ILE94A, ILE94B, LEU13A, LEU13B, LEU141A, LEU141B, LEU153A, LEU153B, LEU19A, LEU19B, LEU316A, LEU316B, LEU319A, LEU319B, LEU320A, LEU320B, LEU322A, LEU322B, LEU324A, LEU324B, LEU334A, LEU336A, LEU336B, LEU357A, LEU357B, LEU77A, LEU77B, LEU88A, LEU88B, LYS291A, LYS291B, LYS296A, LYS296B, LYS359A, LYS359B, LYS363B, PHE292A, PHE292B, PHE346A, PHE346B, PHE86A, PHE91A, PHE91B, PRO144A, PRO144B, PRO18A, PRO18B, PRO295A, PRO295B, PRO337A, PRO337B, PRO342A, PRO342B, PRO93A, PRO93B, SER348A, SER348B, SER350A, SER350B, SER83A, SER83B, THR148A, THR148B, THR149A, THR149B, THR355A, THR355B, THR362A, THR362B, THR95A, THR95B, TRP145A, TRP145B, TRP99A, TRP99B, TYR289A, TYR289B, TYR358A, TYR358B, VAL10A, VAL10B, VAL147A, VAL147B, VAL300B, VAL341A, VAL341B, VAL351A, VAL351B, VAL360A, VAL360B, VAL97A, VAL97B
• A-C: ALA253A, ALA253C, ALA297A, ALA297C, ALA347A, ALA347C, ALA349A, ALA349C, ALA39A, ALA39C, ALA44A, ALA44C, ALA50A, ALA50C, ARG247A, ARG247C, ARG2C, ARG321A, ARG321C, ARG90A, ARG90C, ASN318A, ASN318C, ASN40A, ASN40C, ASN49A, ASN49C, ASN80A, ASN80C, ASP249A, ASP249C, ASP251A, ASP251C, ASP252A, ASP252C, ASP323A, ASP323C, GLN245A, GLN245C, GLN47A, GLN47C, GLN54A, GLN54C, GLN81A, GLN81C, GLU246A, GLU246C, GLU301A, GLU301C, GLU329A, GLU329C, GLU330A, GLU330C, GLU356A, GLU356C, GLU45A, GLU45C, GLU60A, GLU60C, GLU7A, GLU7C, GLU85A, GLU85C, GLY173A, GLY173C, GLY298A, GLY298C, GLY326A, GLY326C, GLY328A, GLY328C, GLY43A, GLY43C, GLY48A, GLY48C, GLY78A, GLY78C, GLY84A, GLY84C, GLY89A, GLY89C, HIS345A, HIS345C, HIS352A, HIS352C, ILE248A, ILE248C, ILE52A, ILE52C, ILE79A, ILE79C, LEU21A, LEU21C, LEU250A, LEU250C, LEU303A, LEU303C, LEU319A, LEU319C, LEU320A, LEU320C, LEU322A, LEU322C, LEU324A, LEU324C, LEU331A, LEU331C, LEU344A, LEU344C, LEU55A, LEU55C, LEU58A, LEU58C, LEU59A, LEU59C, LEU70A, LEU70C, LEU73A, LEU73C, LEU88A, LEU88C, LYS175A, LYS175C, LYS57A, LYS57C, LYS5A, LYS5C, LYS82A, LYS82C, PHE26A, PHE26C, PHE346A, PHE346C, PHE86A, PHE86C, PHE91A, PHE91C, PRO174A, PRO174C, PRO22A, PRO22C, PRO72A, PRO72C, PRO76A, PRO76C, PRO93A, SER20A, SER20C, SER348A, SER348C, SER350A, SER350C, SER83A, SER83C, THR327A, THR327C, THR332A, THR332C, THR355A, THR355C, THR87A, THR87C, TYR24A, TYR24C, TYR302A, TYR302C, TYR325A, TYR325C, TYR53A, TYR53C, VAL23A, VAL23C, VAL300A, VAL300C, VAL317C, VAL351A, VAL351C, VAL3A, VAL3C, VAL46A, VAL46C, VAL51A, VAL51C, VAL71A, VAL71C
• A-D: ALA14A, ALA14D, ALA15A, ALA15D, ALA74A, ALA74D, ASN40A, ASN40D, ASN49A, ASN49D, ASN75A, ASN75D, ASN80A, ASN80D, ASP92A, ASP92D, GLN17A, GLN17D, GLN81A, GLN81D, GLU12A, GLU12D, GLU85A, GLU85D, GLY16A, GLY16D, GLY43A, GLY43D, GLY78A, GLY78D, GLY84A, GLY84D, GLY96A, GLY96D, ILE79A, ILE79D, ILE94A, ILE94D, LEU13A, LEU13D, LEU19A, LEU19D, LEU21A, LEU21D, LEU73A, LEU73D, LEU77A, LEU77D, LEU88A, LEU88D, LYS82A, LYS82D, PHE86A, PHE86D, PHE91A, PHE91D, PRO18A, PRO18D, PRO22A, PRO22D, PRO72A, PRO72D, PRO76A, PRO76D, PRO93A, PRO93D, SER20A, SER20D, SER83A, SER83D, THR87A, THR87D, THR95A, THR95D, VAL10A, VAL10D, VAL46A, VAL46D
• B-C: ALA14B, ALA14C, ALA15B, ALA15C, ALA74B, ALA74C, ASN40B, ASN40C, ASN49B, ASN49C, ASN75B, ASN75C, ASN80B, ASN80C, ASP92B, ASP92C, GLN17B, GLN17C, GLN81B, GLN81C, GLU12B, GLU12C, GLU85B, GLU85C, GLY16B, GLY16C, GLY43B, GLY43C, GLY78B, GLY78C, GLY84B, GLY84C, GLY96B, GLY96C, ILE79B, ILE79C, ILE94B, ILE94C, LEU13B, LEU13C, LEU19B, LEU19C, LEU21B, LEU21C, LEU73B, LEU73C, LEU77B, LEU77C, LEU88B, LEU88C, LYS82B, LYS82C, PHE86B, PHE86C, PHE91B, PHE91C, PRO18B, PRO18C, PRO22B, PRO22C, PRO72B, PRO72C, PRO76B, PRO76C, PRO93B, PRO93C, SER20B, SER20C, SER83B, SER83C, THR149B, THR87B, THR87C, THR95B, THR95C, VAL10B, VAL46B, VAL46C
• B-D: ALA253B, ALA253D, ALA297B, ALA297D, ALA347B, ALA347D, ALA349B, ALA349D, ALA39B, ALA39D, ALA44B, ALA44D, ALA50B, ALA50D, ARG247B, ARG247D, ARG321B, ARG321D, ARG90B, ARG90D, ASN318B, ASN318D, ASN40B, ASN40D, ASN49B, ASN49D, ASN80B, ASN80D, ASP249B, ASP249D, ASP251B, ASP251D, ASP252B, ASP252D, ASP323B, ASP323D, ASP4D, GLN245B, GLN245D, GLN47B, GLN47D, GLN54B, GLN54D, GLN81B, GLN81D, GLU246B, GLU246D, GLU301B, GLU301D, GLU329D, GLU330B, GLU330D, GLU356B, GLU356D, GLU45B, GLU45D, GLU60B, GLU60D, GLU7B, GLU7D, GLU85B, GLU85D, GLY173B, GLY173D, GLY298B, GLY298D, GLY326B, GLY326D, GLY328B, GLY328D, GLY43B, GLY43D, GLY48B, GLY48D, GLY84B, GLY84D, GLY89B, GLY89D, HIS345B, HIS345D, HIS352B, HIS352D, ILE248B, ILE248D, ILE52B, ILE52D, ILE79B, ILE79D, LEU21B, LEU21D, LEU250B, LEU250D, LEU303B, LEU303D, LEU319B, LEU319D, LEU320B, LEU320D, LEU322B, LEU322D, LEU324B, LEU324D, LEU331B, LEU331D, LEU344B, LEU344D, LEU55B, LEU55D, LEU58B, LEU58D, LEU59B, LEU59D, LEU70B, LEU70D, LEU73B, LEU73D, LEU88B, LEU88D, LYS175B, LYS175D, LYS57B, LYS57D, LYS5B, LYS5D, LYS82B, LYS82D, PHE26B, PHE26D, PHE346B, PHE346D, PHE86B, PHE86D, PHE91B, PHE91D, PRO174B, PRO174D, PRO22B, PRO22D, PRO72B, PRO72D, PRO76B, PRO76D, PRO93B, SER20B, SER20D, SER348B, SER348D, SER350B, SER350D, SER83B, SER83D, THR327B, THR327D, THR332B, THR332D, THR355B, THR355D, THR87B, THR87D, TYR24B, TYR24D, TYR302B, TYR302D, TYR325B, TYR325D, TYR53B, TYR53D, VAL23B, VAL300B, VAL300D, VAL333B, VAL351B, VAL351D, VAL3B, VAL3D, VAL46B, VAL46D, VAL51B, VAL51D, VAL71B, VAL71D
• C-D: ALA14C, ALA14D, ALA15C, ALA15D, ALA294C, ALA294D, ALA297C, ALA297D, ALA312C, ALA312D, ALA347C, ALA347D, ALA349C, ALA349D, ARG101C, ARG101D, ARG152C, ARG152D, ARG290C, ARG290D, ARG321C, ARG321D, ARG335C, ARG335D, ARG90C, ARG90D, ARG9C, ARG9D, ASN143C, ASN143D, ASN288C, ASN288D, ASN98C, ASN98D, ASP323C, ASP323D, ASP339C, ASP339D, ASP92C, ASP92D, GLN17C, GLN17D, GLN353C, GLN353D, GLN81C, GLN81D, GLU12C, GLU12D, GLU338C, GLU338D, GLU356C, GLU356D, GLY11C, GLY11D, GLY146C, GLY146D, GLY150C, GLY150D, GLY16C, GLY16D, GLY298C, GLY298D, GLY340C, GLY340D, GLY354C, GLY354D, GLY96C, GLY96D, HIS151C, HIS151D, HIS293C, HIS293D, HIS352C, HIS352D, ILE94C, ILE94D, LEU13C, LEU13D, LEU141C, LEU141D, LEU153C, LEU153D, LEU19C, LEU19D, LEU316C, LEU316D, LEU319C, LEU319D, LEU320C, LEU320D, LEU322C, LEU322D, LEU324C, LEU324D, LEU336C, LEU336D, LEU357C, LEU357D, LEU77C, LEU77D, LEU88C, LEU88D, LYS291C, LYS291D, LYS296C, LYS296D, LYS359C, LYS359D, LYS363C, LYS363D, PHE292C, PHE292D, PHE346C, PHE346D, PHE86C, PHE91C, PHE91D, PRO144C, PRO144D, PRO18C, PRO18D, PRO295C, PRO295D, PRO337C, PRO337D, PRO342C, PRO342D, PRO93C, PRO93D, SER348C, SER348D, SER350C, SER350D, SER83C, SER83D, THR148C, THR148D, THR149C, THR149D, THR355C, THR355D, THR362C, THR362D, THR95C, THR95D, TRP145C, TRP145D, TRP99C, TRP99D, TYR289C, TYR289D, TYR358C, TYR358D, VAL10C, VAL10D, VAL147C, VAL147D, VAL300C, VAL300D, VAL341C, VAL341D, VAL351C, VAL351D, VAL360C, VAL360D, VAL97C, VAL97D