3FXA

crystal structure of a putative sugar-phosphate isomerase (lmof2365_0531) from listeria monocytogenes str. 4b f2365 at 1.60 a resolution

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 111
  • Norm. En. per Res.: -4.0222
• 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	-9.3094	32.8452	-587.057	-563.5213	203	13	20	25057	3	38	39
A-C	-20.3473	-17.0788	-100.784	-138.2101	56	3	0	3669	2	8	8
A-D	-59.2442	-47.4204	-339.799	-446.4636	111	8	11	12796	4	27	29
B-C	-56.5828	-41.7777	-343.03	-441.3905	112	6	11	12535	4	27	29
B-D	-20.4628	-19.5846	-94.6154	-134.6628	54	5	0	3647	4	10	8
C-D	-3.7547	34.1644	-574.873	-544.4634	204	7	21	24876	3	39	39

Interface residues

• A-B: ALA155A, ALA155B, ALA157A, ALA157B, ALA161A, ALA161B, ALA164A, ALA164B, ALA168A, ALA168B, ALA18A, ALA18B, ALA192A, ALA20A, ALA20B, ALA32A, ALA32B, ALA58A, ALA58B, ALA59A, ALA59B, ALA5A, ALA5B, ARG23A, ARG23B, ASN109B, ASN152A, ASN152B, ASN178A, ASN178B, ASN19A, ASN19B, ASN67A, ASN67B, ASN9A, ASN9B, ASP149A, ASP149B, ASP167A, ASP167B, ASP2A, ASP2B, ASP8B, CYS172A, CYS172B, CYS52A, CYS52B, CYS68A, CYS68B, GLN12A, GLN12B, GLN15A, GLN15B, GLN183A, GLN183B, GLN4A, GLN4B, GLU106A, GLU106B, GLU147A, GLU147B, GLU16A, GLU16B, GLU17A, GLU17B, GLU182A, GLU182B, GLU26A, GLU26B, GLU30A, GLU30B, GLU31A, GLU31B, GLU38A, GLU38B, GLU70A, GLU70B, GLY0B, GLY105A, GLY105B, GLY190A, GLY190B, GLY191A, GLY53A, GLY53B, GLY56A, GLY56B, HIS11A, HIS11B, HIS188A, HIS188B, HIS64A, HIS64B, ILE10A, ILE10B, ILE163A, ILE163B, ILE170A, ILE170B, ILE187A, ILE187B, ILE21A, ILE21B, ILE69A, ILE69B, ILE6A, ILE6B, LEU154A, LEU154B, LEU173A, LEU173B, LEU24A, LEU24B, LEU33A, LEU33B, LEU62A, LEU62B, LEU7A, LEU7B, LYS181A, LYS181B, LYS35A, LYS35B, LYS3A, LYS3B, LYS60A, LYS60B, LYS61A, LYS61B, PHE140A, PHE140B, PHE151A, PHE151B, PHE166A, PHE166B, PHE184A, PHE184B, PHE66A, PHE66B, PHE75A, PHE75B, PRO141A, PRO141B, PRO148A, PRO148B, PRO150A, PRO150B, PRO25A, PRO25B, SER158A, SER165A, SER165B, SER185A, SER185B, SER22A, SER22B, SER29A, SER29B, SER55A, SER55B, SER65A, SER65B, THR104A, THR104B, THR13A, THR13B, THR156A, THR156B, THR159A, THR159B, THR175A, THR175B, THR180A, THR180B, THR28A, THR28B, THR36A, THR36B, THR54A, THR54B, TRP14A, TRP14B, TYR176A, TYR176B, TYR179A, TYR179B, VAL142A, VAL142B, VAL162B, VAL169A, VAL169B, VAL171A, VAL171B, VAL27A, VAL27B, VAL34A, VAL34B, VAL37A, VAL37B, VAL57A, VAL57B, VAL63A, VAL63B
• A-C: ALA50A, ALA50C, ALA81A, ALA81C, ASN109A, ASN109C, ASP80A, ASP80C, CYS52A, CYS52C, GLU106A, GLU106C, GLY105A, GLY105C, GLY191A, GLY191C, GLY51A, GLY51C, GLY53A, GLY53C, GLY56A, GLY56C, GLY84A, GLY84C, HIS83A, HIS83C, LEU107A, LEU107C, LEU110A, LEU154A, LEU154C, LEU76A, LEU76C, LYS60A, LYS60C, PHE75A, PHE75C, PRO78A, PRO78C, SER55A, SER55C, SER79A, SER79C, SER99A, THR104A, THR104C, THR54A, THR54C, THR77A, THR77C, THR85A, THR85C, VAL57A, VAL57C, VAL82A, VAL82C
• A-D: ALA113A, ALA113D, ALA192A, ALA73A, ALA73D, ALA81A, ALA81D, ARG71A, ARG71D, ASN109A, ASN109D, ASN67A, ASN67D, ASP80A, ASP80D, ASP93A, ASP93D, CYS114A, CYS114D, CYS68A, CYS68D, GLN183A, GLN183D, GLN90A, GLN90D, GLU106D, GLU182A, GLU182D, GLU70A, GLU70D, GLU92A, GLY105D, GLY190A, GLY190D, GLY191A, GLY45A, GLY45D, GLY84A, GLY84D, GLY87A, GLY87D, HIS188A, HIS188D, HIS64A, HIS64D, HIS83A, HIS83D, ILE111D, ILE187A, ILE187D, ILE47A, ILE47D, ILE69A, ILE69D, LEU110A, LEU110D, LEU76A, LEU76D, LEU86A, LEU86D, LEU89A, LEU89D, LYS115A, LYS115D, LYS117A, LYS117D, LYS46A, LYS46D, LYS60A, LYS60D, LYS91A, LYS91D, PHE184A, PHE184D, PHE66A, PHE66D, PHE75A, PHE75D, PRO112A, PRO112D, PRO189A, PRO189D, PRO72A, PRO72D, PRO78D, SER185A, SER185D, SER65A, SER65D, SER79A, SER79D, THR116A, THR116D, THR44A, THR44D, THR85A, THR85D, TYR179A, TYR179D, VAL186A, VAL186D, VAL48A, VAL48D, VAL63A, VAL63D, VAL74A, VAL74D, VAL82A, VAL82D, VAL88A, VAL88D
• B-C: ALA113B, ALA113C, ALA73B, ALA73C, ALA81B, ALA81C, ARG71B, ARG71C, ASN109B, ASN109C, ASN67B, ASN67C, ASP80B, ASP80C, ASP93B, ASP93C, CYS114B, CYS114C, CYS68B, CYS68C, GLN183B, GLN183C, GLN90B, GLN90C, GLU106B, GLU106C, GLU182B, GLU182C, GLU70B, GLU70C, GLY105B, GLY190B, GLY190C, GLY191C, GLY45B, GLY45C, GLY84B, GLY84C, GLY87B, GLY87C, HIS188B, HIS188C, HIS64B, HIS64C, HIS83B, HIS83C, ILE111B, ILE111C, ILE187B, ILE187C, ILE47B, ILE47C, ILE69B, ILE69C, LEU110B, LEU110C, LEU76B, LEU76C, LEU86B, LEU86C, LEU89B, LEU89C, LYS115B, LYS115C, LYS117B, LYS117C, LYS46B, LYS46C, LYS60B, LYS60C, LYS91B, LYS91C, PHE184B, PHE184C, PHE66B, PHE66C, PHE75B, PHE75C, PRO112B, PRO112C, PRO189B, PRO189C, PRO72B, PRO72C, PRO78B, SER185B, SER185C, SER65B, SER65C, SER79B, SER79C, THR116B, THR116C, THR44B, THR44C, THR77B, THR85B, THR85C, TYR179B, TYR179C, VAL186B, VAL186C, VAL48B, VAL48C, VAL63B, VAL63C, VAL74B, VAL74C, VAL82B, VAL82C, VAL88B, VAL88C
• B-D: ALA50B, ALA50D, ALA81B, ALA81D, ASN109B, ASN109D, ASP80B, ASP80D, CYS52B, CYS52D, GLU106B, GLU106D, GLY105B, GLY105D, GLY51B, GLY51D, GLY53B, GLY53D, GLY56B, GLY56D, GLY84B, GLY84D, HIS83B, HIS83D, LEU107B, LEU107D, LEU110B, LEU154B, LEU154D, LEU76B, LEU76D, LYS60B, LYS60D, PHE75B, PHE75D, PRO78B, PRO78D, SER55B, SER55D, SER79B, SER79D, SER99B, THR104B, THR104D, THR54B, THR54D, THR77B, THR77D, THR85B, THR85D, VAL57B, VAL57D, VAL82B, VAL82D
• C-D: ALA155C, ALA155D, ALA157C, ALA157D, ALA161C, ALA161D, ALA164C, ALA164D, ALA168C, ALA168D, ALA18C, ALA18D, ALA20C, ALA20D, ALA32C, ALA32D, ALA41D, ALA58C, ALA58D, ALA59C, ALA59D, ALA5C, ALA5D, ARG23C, ARG23D, ASN109D, ASN152C, ASN152D, ASN178C, ASN178D, ASN19C, ASN19D, ASN67C, ASN67D, ASN9C, ASN9D, ASP149C, ASP149D, ASP167C, ASP167D, ASP2C, ASP2D, ASP8C, ASP8D, CYS172C, CYS172D, CYS52C, CYS52D, CYS68C, CYS68D, GLN12C, GLN12D, GLN15C, GLN15D, GLN183C, GLN183D, GLN4C, GLN4D, GLU106C, GLU106D, GLU147C, GLU147D, GLU16C, GLU16D, GLU17C, GLU17D, GLU182C, GLU182D, GLU26C, GLU26D, GLU30C, GLU30D, GLU31C, GLU31D, GLU38C, GLU38D, GLU42D, GLU70C, GLU70D, GLY0C, GLY0D, GLY105C, GLY105D, GLY190C, GLY190D, GLY191C, GLY53C, GLY53D, GLY56C, GLY56D, HIS11C, HIS11D, HIS188C, HIS188D, HIS64C, HIS64D, ILE10C, ILE10D, ILE163C, ILE163D, ILE170C, ILE170D, ILE187C, ILE187D, ILE21C, ILE21D, ILE69C, ILE69D, ILE6C, ILE6D, LEU154C, LEU154D, LEU173C, LEU173D, LEU24C, LEU24D, LEU33C, LEU33D, LEU62C, LEU62D, LEU7C, LEU7D, LYS181C, LYS181D, LYS35C, LYS35D, LYS3C, LYS3D, LYS60C, LYS60D, LYS61C, LYS61D, PHE140C, PHE140D, PHE151C, PHE151D, PHE166C, PHE166D, PHE184C, PHE184D, PHE66C, PHE66D, PHE75C, PHE75D, PRO148C, PRO148D, PRO150C, PRO150D, PRO25C, PRO25D, SER158C, SER158D, SER165C, SER165D, SER185D, SER22C, SER22D, SER29C, SER29D, SER55C, SER55D, SER65C, SER65D, THR104C, THR104D, THR13C, THR13D, THR156C, THR156D, THR159C, THR159D, THR175C, THR175D, THR180C, THR180D, THR28C, THR28D, THR36C, THR36D, THR54C, THR54D, TRP14C, TRP14D, TYR176C, TYR176D, TYR179C, TYR179D, VAL142C, VAL142D, VAL162C, VAL169C, VAL169D, VAL171C, VAL171D, VAL27C, VAL27D, VAL34C, VAL34D, VAL37C, VAL37D, VAL57C, VAL57D, VAL63C, VAL63D