3PV5

structure of legionella fallonii degq (n189g/p190g variant)

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 80
  • Norm. En. per Res.: -2.8916
• Hub Node: A(2)

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-C	-35.4453	8.7437	-193.851	-220.5526	93	5	5	8089	0	15	11
A-D	-23.5567	-4.1023	-107.15	-134.809	92	4	0	5582	2	26	26
B-C	-67.9907	6.6466	-206.779	-268.1231	95	7	7	8565	0	12	7
B-D	-57.6712	-7.7569	-165.896	-231.3241	80	10	6	7132	1	12	7
C-D	-47.4235	-3.5788	-184.585	-235.5873	85	5	7	8221	0	10	7

Interface residues

• A-C: ALA260C, ALA262C, ALA290C, ALA359C, ALA362C, ALA381C, ARG327C, ARG361A, ARG361C, ARG429A, ASN278C, ASN280C, ASN352C, ASN372A, ASN402A, ASP292C, ASP328C, ASP408C, GLN253C, GLN261C, GLN276C, GLN365A, GLN377A, GLN377C, GLN413C, GLN426A, GLU258C, GLU345C, GLU364A, GLU366A, GLU422A, GLY249C, GLY264C, GLY291C, GLY357C, GLY371A, GLY380C, GLY430A, GLY432A, HIS254C, HIS344C, HIS370A, ILE250C, ILE293C, ILE399A, ILE439A, LEU255C, LEU259C, LEU273C, LEU348C, LEU355C, LEU358C, LEU360C, LEU412C, LEU423A, LEU424A, LEU428A, LEU436A, LEU437A, LYS289C, LYS403A, LYS410C, LYS420A, LYS421A, MET263C, MET434A, PHE251C, PHE363A, PRO257C, PRO279C, PRO368A, PRO369A, PRO431A, SER275C, SER281C, SER367A, SER382C, SER433A, THR256C, TYR265C, TYR356C, TYR435A, VAL252C, VAL274C, VAL277C, VAL373A, VAL376C, VAL378C, VAL379C, VAL409C, VAL425A, VAL427A, VAL438A
• A-D: ALA104A, ALA104D, ALA122A, ALA122D, ALA24A, ALA386A, ALA386D, ALA390A, ALA390D, ARG100A, ARG100D, ARG101A, ARG101D, ARG105D, ARG389A, ARG389D, ARG393A, ARG393D, ASN124D, ASN156A, ASN384A, ASN384D, ASP121A, ASP121D, ASP98A, ASP98D, GLN26A, GLN26D, GLN346A, GLN346D, GLN349A, GLN349D, GLU345A, GLU345D, GLU383A, GLU383D, GLU422D, GLU64A, GLU64D, GLY155A, GLY27A, GLY27D, GLY387D, GLY391A, GLY391D, GLY99A, GLY99D, ILE392D, ILE439A, ILE439D, ILE92A, ILE92D, LEU102A, LEU102D, LEU436D, LEU437A, LEU437D, LEU91A, LEU91D, LEU96A, LEU96D, LYS103A, LYS103D, LYS123A, LYS123D, LYS342A, LYS342D, LYS421A, LYS421D, LYS62A, LYS62D, MET434D, PHE154A, SER382A, SER382D, SER385A, SER385D, SER90A, SER90D, THR93A, THR93D, THR95A, THR95D, TRP388A, TRP388D, TYR28A, TYR28D, TYR356D, VAL438A, VAL438D, VAL94A, VAL94D
• B-C: ALA10C, ALA144C, ALA160C, ALA167B, ALA186B, ALA186C, ALA187B, ALA187C, ALA200B, ALA260B, ARG100C, ARG101C, ASN124C, ASN147C, ASN199B, ASN218B, ASN218C, ASP140B, ASP185B, ASP185C, ASP268B, ASP98C, GLN158C, GLN183B, GLN261B, GLN270B, GLN97C, GLU137B, GLU203B, GLU258B, GLU267B, GLY139B, GLY146C, GLY150C, GLY163B, GLY163C, GLY189C, GLY190C, GLY191C, GLY202B, GLY217B, GLY220B, GLY220C, GLY222B, GLY99C, HIS254B, ILE145C, ILE164B, ILE188C, ILE205B, ILE211B, ILE221B, ILE66C, LEU102C, LEU136B, LEU13C, LEU151C, LEU168B, LEU259B, LEU96C, LYS126C, LYS135B, LYS14C, LYS201B, MET17C, MET6C, MET9B, MET9C, PHE141B, PHE141C, PHE149C, PHE162B, PHE162C, PHE223B, PRO11C, PRO148C, PRO18C, PRO257B, PRO7B, PRO7C, SER159C, SER166B, SER8C, THR161C, THR184B, THR256B, THR95C, VAL12C, VAL138B, VAL142B, VAL142C, VAL143C, VAL165B, VAL219B, VAL219C
• B-D: ALA10B, ALA144B, ALA160B, ALA167D, ALA186B, ALA186D, ALA187B, ALA187D, ALA200D, ARG100B, ARG101B, ASN124B, ASN147B, ASN199D, ASN218B, ASP140D, ASP185B, ASP185D, ASP98B, GLN158B, GLN183D, GLN97B, GLU137D, GLU258D, GLU267D, GLY139D, GLY146B, GLY150B, GLY163B, GLY163D, GLY189B, GLY190B, GLY191B, GLY220B, GLY220D, GLY222D, GLY99B, HIS254D, ILE145B, ILE164D, ILE188B, ILE211D, ILE221D, LEU102B, LEU136D, LEU13B, LEU151B, LEU168D, LEU259D, LYS14B, LYS169D, LYS201D, MET17B, MET9B, MET9D, PHE141B, PHE141D, PHE149B, PHE162B, PHE162D, PHE223D, PRO11B, PRO148B, PRO257D, PRO7B, SER157B, SER159B, SER166D, SER8B, THR161B, THR184D, THR256D, VAL12B, VAL138D, VAL142B, VAL142D, VAL143B, VAL165D, VAL219B, VAL219D
• C-D: ALA10D, ALA144D, ALA160D, ALA167C, ALA186C, ALA186D, ALA187C, ALA187D, ALA200C, ALA200D, ARG100D, ARG101D, ARG170C, ASN124D, ASN147D, ASN156D, ASN218C, ASP140C, ASP185C, ASP185D, ASP98D, GLN158D, GLN183C, GLN261C, GLN97D, GLU137C, GLU258C, GLU267C, GLY139C, GLY146D, GLY150D, GLY163C, GLY163D, GLY189D, GLY190D, GLY191D, GLY217C, GLY220C, GLY220D, GLY222C, GLY99D, HIS254C, ILE145D, ILE164C, ILE188D, ILE211C, ILE221C, ILE221D, LEU136C, LEU13D, LEU151D, LEU168C, LEU259C, LYS126D, LYS14D, LYS169C, LYS201C, MET17D, MET9C, MET9D, PHE141C, PHE141D, PHE149D, PHE162C, PHE162D, PHE223C, PRO11D, PRO148D, PRO257C, PRO7C, PRO7D, SER157D, SER159D, SER166C, SER8D, THR161D, THR184C, THR256C, VAL12D, VAL138C, VAL142D, VAL143D, VAL165C, VAL219C, VAL219D