3F79

structure of pseudo-centered cell crystal form of the c- terminal phosphatase domain of p. aeruginosa rssb

• Total interactions analyzed: 15
• Total true interactions: 8
• Strongest Interaction:
  • Chains: E-F
  • Int. Res.: 124
  • Norm. En. per Res.: -2.0195
• 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	-4.755	20.0898	-199.179	-183.8442	119	44	22	12992	0	17	33
A-D	0.0	0.0	-6.4458	-6.4458	28	0	0	504	0	5	7
A-E	0.0	0.0	-20.067	-20.067	30	0	0	885	0	3	7
B-D	-7.0088	1.4181	-109.406	-114.9967	68	11	0	4969	0	20	21
C-D	-36.1088	53.5539	-208.681	-191.2359	114	52	21	12682	2	17	26
C-E	0.0	0.0	-2.0454	-2.0454	15	0	0	298	0	4	5
D-E	-12.3863	-1.5821	-103.263	-117.2315	64	4	1	4340	0	17	18
E-F	-4.2457	5.0137	-251.181	-250.413	124	43	22	14014	0	16	23

Interface residues

• A-B: ALA158A, ALA158B, ALA216A, ALA216B, ALA219A, ALA219B, ARG160A, ARG160B, ARG231A, ARG231B, ARG237A, ARG237B, ARG256A, ARG256B, ASN150A, ASN150B, ASN157A, ASN157B, ASN165A, ASN165B, ASN255B, ASN260A, ASN260B, ASP155A, ASP155B, ASP195B, GLN153A, GLN153B, GLN156A, GLN156B, GLN161A, GLN161B, GLN163A, GLN163B, GLU154A, GLU154B, GLU235A, GLU235B, GLU379A, GLU379B, GLY159A, GLY159B, GLY191A, GLY191B, GLY213A, GLY215A, GLY215B, GLY257A, GLY257B, GLY264A, GLY264B, HIS214A, HIS214B, HIS253A, HIS253B, ILE254A, ILE254B, ILE259B, LEU149A, LEU149B, LEU151A, LEU151B, LEU152A, LEU152B, LEU167A, LEU187A, LEU187B, LEU189A, LEU189B, LEU224A, LEU224B, LEU225A, LEU225B, LEU232A, LEU232B, LEU258A, LEU258B, LEU263A, LEU263B, LYS226A, LYS226B, LYS262A, LYS262B, LYS265A, LYS265B, PHE193B, PHE220A, PHE220B, PHE227A, PHE227B, PRO381A, SER148A, SER148B, SER186A, SER190A, SER190B, SER217A, SER217B, SER218A, SER218B, THR222A, THR222B, THR229A, THR229B, THR230A, THR230B, THR261A, THR261B, TYR188A, TYR188B, TYR234A, TYR234B, VAL162A, VAL162B, VAL211A, VAL221A, VAL221B, VAL223A, VAL223B
• A-D: ALA158A, ARG160A, ARG198A, ARG202D, ARG306D, ARG321D, ASN157A, ASN165A, ASP155A, ASP275D, ASP319D, ASP320D, GLN161A, GLN163A, GLU154A, GLU244D, GLU277D, GLU324D, GLY159A, LYS246D, LYS278D, PRO247D, SER248D, SER280D, TYR318D, VAL162A, VAL169A, VAL322D
• A-E: ALA360E, ALA361E, ARG198A, ARG202A, ARG391A, ASN279A, ASN392A, ASP200A, GLN299E, GLN357E, GLU175A, GLU201A, GLU277A, GLY176A, GLY298E, GLY362E, ILE174A, LEU177A, LEU276A, LEU347E, LEU354E, LEU368E, LYS350E, PRO327A, SER173A, SER353E, THR346E, TRP172A, VAL341E, VAL358E
• B-D: ALA300D, ALA316B, ALA360D, ARG256B, ARG306B, ARG321D, ASN260B, ASN279D, ASN392D, ASP314B, ASP315B, ASP319B, ASP319D, ASP320D, ASP336B, GLN299D, GLU297D, GLU304D, GLU324D, GLU356D, GLY213B, GLY264B, GLY286B, GLY287B, GLY298D, GLY301D, GLY305D, GLY307B, GLY311B, HIS266B, HIS288B, ILE259B, LEU263B, LEU281D, LEU294D, LEU303D, LEU312B, LEU325D, LEU331D, LYS262B, LYS265B, LYS278D, LYS348B, PHE295D, PHE313B, PHE329D, PRO292D, PRO309B, PRO326D, PRO327D, SER212B, SER217B, SER218B, SER280D, SER328D, SER330D, SER353D, THR261B, THR282D, THR317B, TYR283D, TYR302D, TYR318B, VAL211B, VAL293D, VAL296D, VAL310B, VAL322D
• C-D: ALA158C, ALA158D, ALA216C, ALA216D, ALA219C, ALA219D, ARG160C, ARG160D, ARG231C, ARG231D, ARG256C, ARG256D, ASN150C, ASN150D, ASN157C, ASN157D, ASN165C, ASN165D, ASN260C, ASN260D, ASP155C, ASP155D, ASP195D, GLN153C, GLN153D, GLN156C, GLN156D, GLN161C, GLN161D, GLN163C, GLN163D, GLU154C, GLU154D, GLU235C, GLU235D, GLY159C, GLY159D, GLY191D, GLY215C, GLY215D, GLY257C, GLY257D, GLY264C, GLY264D, HIS214C, HIS214D, HIS253C, HIS253D, ILE254C, ILE254D, LEU149C, LEU149D, LEU151C, LEU151D, LEU152C, LEU152D, LEU167D, LEU187C, LEU187D, LEU189C, LEU189D, LEU224C, LEU224D, LEU225C, LEU225D, LEU232C, LEU232D, LEU233D, LEU258C, LEU258D, LEU263C, LEU263D, LYS226C, LYS226D, LYS262C, LYS262D, LYS265C, LYS265D, PHE193D, PHE197D, PHE220C, PHE220D, PHE227C, PHE227D, PRO168D, PRO381C, SER148C, SER186C, SER186D, SER190C, SER190D, SER217C, SER217D, SER218C, SER218D, THR222C, THR222D, THR229C, THR229D, THR230C, THR230D, THR261C, THR261D, TYR188C, TYR188D, TYR234C, TYR234D, VAL162C, VAL162D, VAL211C, VAL221C, VAL221D, VAL223C, VAL223D
• C-E: ALA158C, ARG321E, ASN157C, ASN165C, ASP320E, GLN161C, GLU154C, LYS246E, LYS278E, PRO243E, PRO247E, THR282E, VAL162C, VAL169C, VAL322E
• D-E: ALA300E, ALA316D, ALA360E, ARG306D, ARG321E, ASN260D, ASN279E, ASP314D, ASP315D, ASP319D, ASP336D, GLN299E, GLN357E, GLU297E, GLU304E, GLU324E, GLU356E, GLY213D, GLY264D, GLY286D, GLY287D, GLY298E, GLY301E, GLY311D, HIS214D, HIS266D, HIS288D, ILE259D, LEU263D, LEU281E, LEU294E, LEU303E, LEU312D, LEU325E, LEU331E, LYS262D, LYS265D, LYS278E, LYS348D, PHE295E, PHE313D, PHE329E, PRO292E, PRO326E, PRO327E, SER212D, SER217D, SER218D, SER280E, SER328E, SER330E, SER353E, THR261D, THR268D, THR317D, TYR283E, TYR302E, TYR318D, VAL211D, VAL221D, VAL293E, VAL296E, VAL310D, VAL322E
• E-F: ALA147E, ALA147F, ALA158E, ALA158F, ALA216E, ALA216F, ALA219E, ALA219F, ARG160E, ARG160F, ARG231E, ARG231F, ARG237F, ARG238F, ARG256E, ARG256F, ASN150E, ASN150F, ASN157E, ASN157F, ASN165E, ASN165F, ASN255E, ASN260E, ASN260F, ASP155E, ASP155F, ASP195E, ASP195F, GLN153E, GLN153F, GLN156E, GLN156F, GLN161E, GLN161F, GLN163E, GLN163F, GLU154E, GLU154F, GLU235E, GLU235F, GLU379E, GLY159E, GLY159F, GLY191E, GLY215E, GLY215F, GLY257E, GLY257F, GLY264E, GLY264F, HIS214E, HIS214F, HIS253E, HIS253F, ILE254E, ILE254F, ILE259E, ILE259F, LEU149E, LEU149F, LEU151E, LEU151F, LEU152E, LEU152F, LEU167F, LEU187E, LEU187F, LEU189E, LEU189F, LEU224E, LEU224F, LEU225E, LEU225F, LEU232E, LEU232F, LEU233F, LEU258E, LEU258F, LEU263E, LEU263F, LEU377E, LYS226E, LYS226F, LYS262E, LYS262F, LYS265E, LYS265F, PHE193E, PHE220E, PHE220F, PHE227E, PHE227F, PRO381E, PRO381F, SER148E, SER148F, SER186E, SER186F, SER190E, SER190F, SER217E, SER217F, SER218E, SER218F, SER236F, THR222E, THR222F, THR229E, THR229F, THR230E, THR230F, THR261E, THR261F, TYR188E, TYR188F, TYR234E, TYR234F, VAL162E, VAL162F, VAL221E, VAL221F, VAL223E, VAL223F