3LOB

crystal structure of flock house virus calcium mutant

• Total interactions analyzed: 21
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 164
  • Norm. En. per Res.: -3.3854
• 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	-55.8068	-87.5638	-441.794	-585.1646	186	38	3	20011	6	29	32
A-C	-42.628	-94.5087	-418.073	-555.2097	164	53	4	19205	8	28	33
A-D	0.0	2.5471	-8.8885	-6.3414	24	0	1	977	0	1	2
B-C	-20.2783	-96.0846	-389.514	-505.8769	157	40	3	18137	5	27	29
B-E	0.0	1.915	-8.9027	-6.9876	18	0	2	890	0	6	5
C-F	-6.771	6.1985	-127.923	-128.4955	53	17	9	7589	0	6	7

Interface residues

• A-B: ALA205A, ALA205B, ALA209A, ALA209B, ALA225A, ALA23A, ALA244A, ALA265B, ALA327B, ALA351A, ALA357B, ARG159B, ARG167B, ARG322B, ARG348A, ARG352A, ARG87A, ARG87B, ASN161B, ASN221A, ASN230A, ASN230B, ASN246A, ASN249A, ASN249B, ASN253B, ASN266B, ASN293A, ASN324B, ASN326B, ASP207A, ASP207B, ASP229A, ASP229B, ASP254B, ASP295A, ASP335B, ASP340A, ASP340B, ASP86A, ASP86B, CYS193A, CYS245A, GLN162B, GLN201A, GLN251A, GLN251B, GLN257B, GLN260B, GLN274A, GLN27A, GLN28A, GLN331B, GLN345A, GLU233B, GLU247A, GLU247B, GLU341A, GLU341B, GLU89B, GLY219A, GLY222A, GLY227A, GLY258B, GLY270A, GLY273A, GLY333B, GLY90B, HIS215A, HIS215B, HIS334B, ILE236B, ILE255B, ILE259B, ILE359B, ILE84B, LEU197A, LEU197B, LEU213A, LEU213B, LEU217A, LEU220A, LEU224A, LEU256B, LEU262B, LEU269A, LEU329B, LEU339A, LEU339B, LEU344A, LYS192A, LYS196A, LYS237B, LYS82B, LYS91B, MET294A, MET328B, PHE133A, PHE166B, PHE184B, PHE202A, PHE202B, PHE231B, PHE250A, PHE250B, PHE252B, PHE332B, PHE88B, PRO194A, PRO203A, PRO208A, PRO208B, PRO228A, PRO228B, PRO248A, PRO248B, PRO24A, PRO263B, PRO264B, PRO26A, PRO275A, PRO323B, PRO325B, PRO337B, PRO338B, PRO355B, PRO62B, PRO85A, SER156B, SER158B, SER160B, SER164B, SER165B, SER187B, SER198A, SER198B, SER211A, SER212A, SER212B, SER232B, SER234B, SER268B, SER271A, SER336B, SER353A, THR155B, THR157B, THR189B, THR199A, THR199B, THR206A, THR206B, THR210A, THR210B, THR216A, THR216B, THR22A, THR261B, THR272A, THR296A, THR349A, TRP191A, TRP291A, TYR330B, TYR347A, VAL163B, VAL190B, VAL195A, VAL200A, VAL200B, VAL204A, VAL204B, VAL214A, VAL214B, VAL218A, VAL223A, VAL226A, VAL25A, VAL267B, VAL288B, VAL298A, VAL350A, VAL356A, VAL356B, VAL358B, VAL92B
• A-C: ALA205A, ALA205C, ALA209A, ALA209C, ALA225C, ALA244C, ALA265A, ALA327A, ALA343C, ALA351C, ARG159A, ARG167A, ARG322A, ARG348C, ARG352C, ARG87A, ARG87C, ASN161A, ASN221C, ASN230C, ASN246C, ASN249A, ASN249C, ASN253A, ASN253C, ASN266A, ASN293C, ASN324A, ASN326A, ASP207A, ASP207C, ASP229C, ASP254A, ASP295C, ASP335A, ASP340A, ASP340C, ASP86A, CYS193C, CYS245C, GLN162A, GLN201C, GLN251A, GLN251C, GLN257A, GLN260A, GLN274C, GLN331A, GLN345C, GLU247C, GLU341A, GLU341C, GLU346C, GLU89A, GLY219C, GLY222C, GLY227C, GLY258A, GLY270C, GLY273C, GLY333A, GLY90A, HIS215A, HIS215C, HIS334A, ILE255A, ILE259A, ILE84A, LEU197A, LEU197C, LEU213A, LEU213C, LEU217C, LEU220C, LEU224C, LEU256A, LEU262A, LEU329A, LEU339A, LEU339C, LEU344C, LYS192C, LYS196C, LYS82A, LYS91A, MET294C, MET328A, PHE133C, PHE166A, PHE202A, PHE202C, PHE250A, PHE250C, PHE252A, PHE332A, PHE88A, PRO194C, PRO203A, PRO203C, PRO208C, PRO228C, PRO248A, PRO248C, PRO263A, PRO264A, PRO275C, PRO323A, PRO325A, PRO337A, PRO338A, PRO85A, SER156A, SER158A, SER160A, SER164A, SER165A, SER198A, SER198C, SER211A, SER211C, SER212A, SER212C, SER268A, SER271C, SER336A, SER353C, THR155A, THR157A, THR199A, THR199C, THR206A, THR206C, THR210A, THR210C, THR216A, THR216C, THR261A, THR272C, THR296C, THR349C, TRP191C, TRP291C, TYR321A, TYR330A, TYR347C, VAL163A, VAL195C, VAL200A, VAL200C, VAL204A, VAL204C, VAL214A, VAL214C, VAL218C, VAL223C, VAL226C, VAL267A, VAL288A, VAL289A, VAL298C, VAL342C, VAL350C, VAL356C, VAL92A
• A-D: ALA70A, ALA72A, GLN242A, GLU346A, ILE373D, LEU354A, LEU59A, LEU64A, LEU67A, LYS371D, LYS68A, PHE240A, PHE71A, PHE76A, PRO355A, PRO73A, SER353A, SER372D, THR349A, THR57A, THR78A, VAL350A, VAL358A, VAL370D
• B-C: ALA205B, ALA205C, ALA209B, ALA209C, ALA225B, ALA244B, ALA265C, ALA327C, ALA351B, ARG159C, ARG167C, ARG322C, ARG348B, ARG352B, ARG87B, ARG87C, ASN161C, ASN221B, ASN230B, ASN246B, ASN249B, ASN249C, ASN253C, ASN266C, ASN293B, ASN324C, ASN326C, ASP207B, ASP207C, ASP229B, ASP254C, ASP295B, ASP335C, ASP340B, ASP86C, CYS193B, CYS245B, GLN162C, GLN201B, GLN251B, GLN251C, GLN257C, GLN260C, GLN274B, GLN331C, GLN345B, GLU247B, GLU341B, GLU341C, GLU89C, GLY219B, GLY222B, GLY227B, GLY258C, GLY270B, GLY273B, GLY333C, GLY90C, HIS215C, HIS334C, ILE255C, ILE259C, ILE84C, LEU197B, LEU197C, LEU213B, LEU213C, LEU217B, LEU220B, LEU224B, LEU256C, LEU262C, LEU269B, LEU329C, LEU339B, LEU339C, LEU344B, LYS192B, LYS196B, LYS82C, LYS91C, MET294B, MET328C, PHE133B, PHE166C, PHE202B, PHE202C, PHE250B, PHE250C, PHE252C, PHE332C, PHE88C, PRO194B, PRO203B, PRO203C, PRO208B, PRO208C, PRO228B, PRO248B, PRO248C, PRO263C, PRO264C, PRO275B, PRO323C, PRO325C, PRO337C, PRO338C, SER156C, SER158C, SER160C, SER164C, SER165C, SER198B, SER211B, SER211C, SER212B, SER212C, SER268C, SER271B, SER336C, SER353B, THR155C, THR157C, THR199B, THR199C, THR206B, THR206C, THR210B, THR210C, THR216B, THR216C, THR261C, THR272B, THR296B, THR349B, TRP191B, TRP291B, TYR321C, TYR330C, TYR347B, VAL163C, VAL195B, VAL200B, VAL200C, VAL204B, VAL204C, VAL214B, VAL214C, VAL218B, VAL223B, VAL226B, VAL267C, VAL288C, VAL289C, VAL298B, VAL356B, VAL92C
• B-E: ALA72B, ARG369E, ASN77B, GLN242B, GLN362B, GLU368E, LEU354B, LEU64B, LYS371E, LYS68B, PHE71B, PHE76B, PRO355B, PRO73B, SER353B, VAL350B, VAL358B, VAL370E
• C-F: ALA343C, ALA351C, ALA357C, ALA361C, ALA364F, ALA379F, ALA55C, ALA70C, ALA72C, ARG352C, ARG369F, ARG58C, ASN172C, ASN363C, ASP75C, GLN242C, GLN345C, GLN362C, GLU346C, GLU368F, ILE359C, ILE373F, ILE374F, LEU354C, LEU378F, LEU56C, LEU59C, LEU64C, LEU67C, LYS371F, LYS375F, LYS68C, MET366F, PHE240C, PHE71C, PHE76C, PRO355C, PRO73C, PRO74C, SER241C, SER353C, SER365F, SER372F, SER376F, SER377F, THR349C, THR57C, TRP367F, TYR347C, VAL342C, VAL350C, VAL358C, VAL370F