3PL2

crystal structure of a 5-keto-2-deoxygluconokinase (ncgl0155, cgl0158) from corynebacterium glutamicum atcc 13032 kitasato at 1.89 a resolution

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 100
  • Norm. En. per Res.: -3.8325
• 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	-62.4015	-13.628	-304.858	-380.8875	103	5	15	12031	0	15	27
A-C	-14.9295	9.8623	-60.2312	-65.2983	40	3	1	3203	0	2	3
A-D	0.0	-8.6331	-1.5376	-10.1707	17	0	0	241	0	13	13
B-C	0.0	-40.1346	-33.6878	-73.8224	61	3	0	2421	1	33	21
B-D	-15.2658	0.0	-43.6791	-58.9449	26	3	0	1577	0	0	2
C-D	-80.5897	-9.7358	-292.923	-383.2485	100	7	11	11588	0	15	25

Interface residues

• A-B: ALA30A, ALA30B, ALA74A, ALA74B, ARG113A, ARG113B, ASN65A, ASN65B, ASP19A, ASP19B, ASP31A, ASP31B, ASP66A, ASP66B, CYS99A, CYS99B, GLN24A, GLN24B, GLN33A, GLN33B, GLU100A, GLU100B, GLU114A, GLU114B, GLU70A, GLU70B, GLU75A, GLU75B, GLY28A, GLY28B, GLY36A, GLY36B, GLY64A, GLY64B, GLY69A, GLY69B, ILE20A, ILE20B, LEU109A, LEU109B, LEU23A, LEU23B, LEU29A, LEU29B, LEU72A, LEU72B, LYS116A, LYS116B, LYS37A, LYS37B, LYS93A, LYS93B, PHE102A, PHE102B, PHE111A, PHE111B, PHE177A, PHE177B, PHE35A, PHE35B, PHE68A, PHE68B, PHE92A, PHE92B, PHE98A, PHE98B, PRO108A, PRO108B, PRO115A, PRO115B, PRO118A, PRO118B, PRO22A, PRO22B, PRO67A, PRO67B, PRO95A, PRO95B, SER34A, SER34B, THR91A, THR91B, THR94A, THR94B, THR97A, THR97B, TYR110A, TYR110B, TYR112A, TYR112B, TYR21A, TYR21B, TYR38A, TYR38B, TYR71A, TYR71B, VAL18A, VAL18B, VAL27B, VAL32A, VAL32B, VAL96A, VAL96B
• A-C: ALA303A, ARG297A, ARG297C, ARG78A, ASN258C, ASP255C, ASP31A, ASP31C, GLN24A, GLN24C, GLN33A, GLN33C, GLU299A, GLU299C, GLY26C, GLY36A, ILE101C, ILE257A, ILE257C, LEU23A, LEU23C, LEU298A, LEU298C, LYS37A, PHE35A, PRO103C, PRO22A, PRO22C, SER25A, SER25C, SER296C, SER34A, SER34C, THR302A, TYR38A, VAL256C, VAL27A, VAL27C, VAL32A, VAL32C
• A-D: ARG297A, ARG297D, ARG52A, ARG52D, ARG78A, ARG78D, ASP308A, GLU299D, GLU309A, LEU23D, LEU298D, LYS37A, PRO305A, THR306A, TYR21D, TYR38A, TYR38D
• B-C: ALA303B, ALA303C, ALA312B, ALA312C, ALA51B, ALA51C, ARG297B, ARG297C, ARG52B, ARG52C, ARG78B, ARG78C, ASP255B, ASP308B, ASP308C, GLN24B, GLN24C, GLN33B, GLU299B, GLU299C, GLU309B, GLU309C, GLU75C, GLU77B, GLU77C, GLY36B, GLY36C, GLY54B, GLY54C, GLY80B, HIS272C, HIS53B, HIS53C, ILE257B, LEU23B, LEU23C, LEU293B, LEU293C, LEU298B, LEU298C, LEU79B, LEU79C, LYS37C, PHE35B, PHE35C, PRO22C, PRO305B, SER25B, SER296B, SER313C, SER34B, SER34C, THR302B, THR302C, THR306B, THR306C, THR307B, THR307C, TYR38B, TYR38C, VAL32B
• B-D: ASP31B, ASP31D, GLN24B, GLN24D, GLN33B, GLN33D, GLY26B, GLY28B, GLY36D, ILE101B, ILE257B, LEU23B, LEU23D, LEU298B, LEU298D, PHE35D, PRO22D, SER25B, SER25D, SER34B, SER34D, TYR21D, VAL27B, VAL27D, VAL32B, VAL32D
• C-D: ALA30C, ALA30D, ALA74C, ALA74D, ARG113C, ARG113D, ASN65C, ASN65D, ASP19C, ASP19D, ASP31C, ASP31D, ASP66C, ASP66D, CYS99C, CYS99D, GLN24C, GLN24D, GLN33C, GLN33D, GLU100C, GLU100D, GLU114C, GLU114D, GLU70C, GLU70D, GLU75C, GLU75D, GLY28C, GLY28D, GLY36C, GLY36D, GLY64C, GLY64D, GLY69C, GLY69D, ILE20C, ILE20D, LEU109C, LEU23C, LEU23D, LEU29C, LEU29D, LEU72C, LEU72D, LYS116C, LYS116D, LYS37C, LYS37D, LYS93C, LYS93D, PHE102C, PHE102D, PHE111C, PHE111D, PHE177C, PHE177D, PHE35C, PHE35D, PHE68C, PHE68D, PHE92C, PHE92D, PHE98C, PHE98D, PRO108C, PRO108D, PRO115C, PRO115D, PRO118C, PRO118D, PRO22C, PRO22D, PRO67C, PRO67D, PRO95C, PRO95D, SER34C, SER34D, THR94C, THR94D, THR97C, THR97D, TYR110C, TYR110D, TYR112C, TYR112D, TYR21C, TYR21D, TYR38C, TYR38D, TYR71C, TYR71D, VAL18C, VAL18D, VAL27C, VAL32C, VAL32D, VAL96C, VAL96D