1ZZH

structure of the fully oxidized di-heme cytochrome c peroxidase from r. capsulatus

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 141
  • Norm. En. per Res.: -2.511
• 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	-12.5426	-0.4431	-130.125	-143.1107	67	7	4	5777	0	32	23
A-C	0.0	0.0	-0.013	-0.013	3	0	0	9	0	0	2
A-D	-52.4239	-19.2768	-282.357	-354.0577	141	15	11	12616	1	45	20
B-C	-47.7244	-8.8919	-293.221	-349.8373	146	12	10	13138	0	46	23
C-D	-11.309	-1.2962	-138.856	-151.4612	69	9	5	6211	0	28	19

Interface residues

• A-B: ALA225B, ALA237A, ALA237B, ALA240A, ALA240B, ALA242A, ALA242B, ARG100A, ARG235A, ARG235B, ARG81A, ARG81B, ASP103A, ASP232B, ASP243A, ASP243B, ASP244A, ASP98A, ASP98B, GLN282B, GLU221A, GLU221B, GLU226B, GLU245A, GLY218A, GLY218B, GLY224B, GLY234A, GLY234B, GLY99A, HIS264A, HIS264B, LEU228B, LYS222A, LYS222B, LYS233B, LYS267A, LYS267B, LYS78A, PHE217A, PHE217B, PHE236A, PHE236B, PHE248A, PHE248B, PRO216A, PRO216B, PRO223A, PRO223B, SER265A, SER265B, THR239A, THR239B, THR241A, THR241B, TYR215B, TYR246A, TYR246B, VAL219A, VAL219B, VAL220A, VAL220B, VAL227B, VAL238A, VAL238B, VAL247A, VAL247B
• A-C: GLY79C, HIS326A, PRO80C
• A-D: ALA257A, ALA257D, ALA260A, ALA260D, ALA319A, ALA319D, ARG272D, ARG317A, ARG317D, ARG323A, ARG323D, ARG45A, ARG45D, ASN255D, ASN59A, ASN59D, ASP270A, ASP270D, ASP43A, ASP43D, ASP66A, ASP66D, CYS57A, CYS57D, GLN306A, GLN306D, GLN55A, GLN55D, GLU221D, GLU273A, GLU273D, GLU305A, GLU305D, GLU308A, GLU308D, GLU325A, GLU325D, GLU69A, GLU69D, GLY266A, GLY266D, GLY304D, GLY50A, GLY50D, GLY61A, GLY61D, GLY63A, GLY63D, GLY64A, GLY64D, GLY67A, GLY67D, HIS311A, HIS311D, HIS326A, HIS326D, ILE256A, ILE256D, ILE313A, ILE313D, LEU258A, LEU258D, LEU271A, LEU271D, LEU314A, LEU314D, LEU62A, LEU62D, LEU68A, LEU68D, LEU87A, LEU87D, LYS267A, LYS267D, LYS48A, LYS48D, MET132A, MET132D, MET39A, MET39D, MET46A, PHE42A, PHE42D, PHE52A, PHE52D, PRO261A, PRO261D, PRO307A, PRO307D, PRO312A, PRO312D, PRO315A, PRO315D, PRO322A, PRO322D, PRO324A, PRO324D, PRO44A, PRO44D, SER265D, SER318A, SER318D, SER47A, SER47D, SER49A, SER49D, SER53A, SER53D, SER56A, SER56D, SER71A, SER71D, THR168A, THR168D, THR259A, THR259D, THR303A, THR303D, THR321A, THR321D, THR70A, THR70D, TRP269A, TRP269D, TYR135A, TYR262A, TYR262D, VAL268A, VAL268D, VAL309A, VAL309D, VAL310A, VAL310D, VAL316A, VAL316D, VAL51A, VAL51D, VAL60A, VAL60D, VAL65A, VAL65D
• B-C: ALA257B, ALA257C, ALA260B, ALA260C, ALA319B, ALA319C, ARG235B, ARG235C, ARG317B, ARG317C, ARG323B, ARG323C, ARG45B, ARG45C, ASN255B, ASN59B, ASN59C, ASP270B, ASP270C, ASP43B, ASP43C, ASP66B, ASP66C, CYS57B, CYS57C, GLN306B, GLN306C, GLN320C, GLN55B, GLN55C, GLU226B, GLU226C, GLU273B, GLU273C, GLU305B, GLU305C, GLU308B, GLU308C, GLU325B, GLU325C, GLU69B, GLU69C, GLY266B, GLY266C, GLY304B, GLY304C, GLY50B, GLY50C, GLY61B, GLY61C, GLY63B, GLY63C, GLY64B, GLY64C, GLY67B, GLY67C, HIS311B, HIS311C, HIS326B, HIS326C, ILE256B, ILE256C, ILE313B, ILE313C, LEU258B, LEU258C, LEU271B, LEU271C, LEU314B, LEU314C, LEU62B, LEU62C, LEU68B, LEU68C, LEU87B, LEU87C, LYS267B, LYS267C, LYS48B, LYS48C, MET132B, MET132C, MET39B, MET39C, PHE236B, PHE42B, PHE42C, PHE52B, PHE52C, PRO229B, PRO261B, PRO261C, PRO307B, PRO307C, PRO312B, PRO312C, PRO315B, PRO315C, PRO322B, PRO322C, PRO324B, PRO324C, PRO44B, PRO44C, SER318B, SER318C, SER47B, SER47C, SER49B, SER49C, SER53B, SER53C, SER56B, SER56C, SER71B, SER71C, THR168B, THR168C, THR259B, THR259C, THR303B, THR303C, THR321B, THR321C, THR70B, THR70C, TRP269B, TRP269C, TYR135B, TYR135C, TYR262B, TYR262C, VAL268B, VAL268C, VAL309B, VAL309C, VAL310B, VAL310C, VAL316B, VAL316C, VAL51B, VAL51C, VAL60B, VAL60C, VAL65B, VAL65C
• C-D: ALA101D, ALA225C, ALA237C, ALA237D, ALA240C, ALA240D, ALA242C, ALA242D, ARG100C, ARG100D, ARG235C, ARG235D, ARG81C, ARG81D, ASP103D, ASP243C, ASP243D, ASP244D, ASP98C, ASP98D, GLN282C, GLU221C, GLU221D, GLU226C, GLU245D, GLY218C, GLY218D, GLY224C, GLY234C, GLY234D, GLY99D, HIS264C, HIS264D, LEU228C, LYS222C, LYS222D, LYS267C, LYS267D, LYS78C, LYS78D, PHE217C, PHE217D, PHE236C, PHE236D, PHE248C, PHE248D, PRO216C, PRO216D, PRO223C, PRO223D, PRO80C, SER265C, THR239C, THR239D, THR241C, THR241D, TYR215C, TYR215D, TYR246C, TYR246D, VAL219C, VAL219D, VAL220C, VAL220D, VAL227C, VAL238C, VAL238D, VAL247C, VAL247D