3TAF

5-fluorocytosine paired with ddgmp in rb69 gp43

• Total interactions analyzed: 66
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 86
  • Norm. En. per Res.: -1.8308
• 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-B	-35.8001	15.3236	-136.971	-157.4475	86	7	0	5715	5	42	46
A-D	0.0	0.0	-6.1593	-6.1593	12	1	0	556	0	3	1
B-C	0.0	17.1488	-76.07	-58.9211	56	2	0	3530	0	30	23
B-D	0.0	-4.0577	-0.8103	-4.868	4	0	0	89	0	1	2
C-D	-2.1217	-38.0906	-78.9139	-119.1262	134	1	0	4593	1	108	118

Interface residues

• A-B: ALA239A, ARG109B, ARG145B, ARG241A, ARG241B, ARG246A, ARG25A, ARG25B, ARG27A, ARG27B, ARG29A, ASN193B, ASN203A, ASN203B, ASN232A, ASN23A, ASN23B, ASP13A, ASP143B, ASP150B, ASP192B, ASP21A, ASP21B, GLN206A, GLN206B, GLN207A, GLN207B, GLU161B, GLU17A, GLU196B, GLU200B, GLU236A, GLU26A, GLU26B, GLU30A, GLU32A, GLU3A, GLY235A, GLY24B, HIS245A, ILE11A, ILE142B, ILE15A, ILE164B, ILE187B, ILE230A, ILE233A, LEU152B, LEU197B, LEU202A, LEU202B, LYS107B, LYS195A, LYS195B, LYS208B, LYS231A, LYS240A, MET189B, MET199A, MET199B, PHE149B, PHE16A, PHE191B, PHE204B, PHE234A, PHE234B, PRO190B, PRO244A, SER14A, SER163B, SER22A, SER22B, SER237A, SER243A, THR209A, THR238A, THR238B, THR28A, THR28B, TRP162B, TYR188B, TYR19A, TYR33A, TYR92A, VAL148B, VAL31A
• A-D: ALA63D, ASN507A, ASN64D, ASP67D, GLU512A, LEU508A, LEU61D, LYS34D, LYS60D, PHE62D, SER509A, VAL510A
• B-C: ALA46C, ALA721B, ARG384C, ARG642B, ARG74C, ARG750B, ARG751B, ASN645B, ASN711B, ASP452C, ASP643B, ASP77C, CYS41C, GLN45C, GLN70C, GLN754B, GLN773B, GLU181B, GLU43C, GLU722B, GLU747B, GLU755B, GLU758B, GLU762B, GLU766B, GLU76C, GLU770B, GLY694B, GLY697B, GLY79C, HIS40C, HIS646B, ILE78C, LEU170B, LEU693B, LEU753B, LEU80C, LYS435C, LYS60C, LYS696B, LYS73C, LYS769B, MET75C, PHE767B, PRO42C, PRO691B, PRO692B, PRO723B, SER180B, SER44C, SER695B, SER759B, THR644B, TRP647B, TRP713B, TYR763B
• B-D: GLN173B, GLU43D, LYS169B, SER44D
• C-D: ALA491C, ALA491D, ALA502C, ALA502D, ALA721C, ALA721D, ARG467C, ARG467D, ARG494C, ARG494D, ARG519C, ARG519D, ARG642D, ARG656C, ARG656D, ARG658C, ARG658D, ARG665C, ARG665D, ARG668C, ARG668D, ARG685D, ARG719C, ARG719D, ASN495C, ASN495D, ASN505D, ASN645C, ASN645D, ASN675C, ASN675D, ASN676C, ASP452C, ASP452D, ASP466C, ASP466D, ASP468C, ASP468D, ASP515C, ASP515D, ASP517C, ASP521C, ASP521D, ASP524C, ASP524D, ASP649C, ASP649D, ASP652D, ASP664C, ASP714D, GLN376C, GLN376D, GLN493C, GLN493D, GLN678C, GLN678D, GLU100D, GLU375C, GLU375D, GLU497C, GLU497D, GLU501C, GLU501D, GLU512C, GLU525C, GLU525D, GLU528C, GLU657C, GLU657D, GLU672C, GLU672D, GLU716D, GLY487C, GLY496D, GLY717D, HIS504C, HIS504D, HIS646D, HIS679C, ILE498C, ILE498D, ILE499C, ILE526C, ILE526D, LEU490C, LEU490D, LEU514C, LEU514D, LYS102D, LYS2C, LYS2D, LYS378C, LYS378D, LYS465C, LYS465D, LYS477C, LYS477D, LYS483C, LYS483D, LYS500C, LYS500D, LYS527C, LYS527D, LYS529C, LYS529D, LYS531D, LYS532C, LYS653D, LYS677C, LYS677D, LYS724C, PHE520C, PHE520D, PHE522D, PRO661C, SER455C, SER455D, SER523C, SER523D, THR473D, THR476C, THR718C, THR718D, TYR454C, TYR454D, TYR464C, TYR464D, TYR720C, TYR720D, TYR99D, VAL453C, VAL453D, VAL510C, VAL516C