3K2Q

crystal structure of pyrophosphate-dependent phosphofructokinase from marinobacter aquaeolei, northeast structural genomics consortium target mqr88

• Total interactions analyzed: 3
• Total true interactions: 2
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 238
  • Norm. En. per Res.: -3.5227
• Hub Node: A(1)

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	-11.376	-28.0474	-38.5002	-77.9236	44	5	1	2181	2	22	28
B-C	-76.5423	-152.6889	-609.183	-838.4141	238	40	29	25999	10	59	51

Interface residues

• A-B: ALA320A, ALA327A, ALA341B, ARG30A, ARG338B, ARG345B, ASP339B, ASP34A, ASP378B, ASP381B, CYS379B, GLN340B, GLN359B, GLN35A, GLN377B, GLU323A, GLU350A, GLY328A, GLY349A, HIS32A, HIS366B, ILE348A, LEU326A, LEU332A, LYS319A, LYS31A, LYS329A, LYS342B, LYS361B, MET324A, PHE149B, PRO334A, PRO33A, PRO343B, PRO364B, SER347A, THR28A, THR335A, THR376B, TYR315A, TYR367B, TYR382B, VAL337A, VAL337B
• B-C: ALA160B, ALA160C, ALA164B, ALA164C, ALA16B, ALA16C, ALA170B, ALA170C, ALA200B, ALA200C, ALA204B, ALA204C, ALA275B, ALA275C, ALA293B, ALA293C, ALA295B, ALA295C, ALA301B, ALA301C, ALA302B, ALA302C, ALA306B, ALA306C, ALA308B, ALA308C, ALA388B, ALA388C, ALA403B, ALA403C, ALA75B, ALA75C, ARG300B, ARG300C, ARG303B, ARG303C, ARG380B, ARG380C, ARG401B, ARG401C, ARG43B, ARG43C, ARG80B, ARG80C, ASN19B, ASN19C, ASN407B, ASN407C, ASN44B, ASN44C, ASP173B, ASP173C, ASP296B, ASP296C, ASP396B, ASP396C, ASP397B, ASP397C, CYS178B, CYS178C, CYS79B, CYS79C, GLN10B, GLN10C, GLN206B, GLN206C, GLN299B, GLN299C, GLN384B, GLN384C, GLU169B, GLU169C, GLU179B, GLU179C, GLU188B, GLU188C, GLU210B, GLU210C, GLU247B, GLU247C, GLU390B, GLU390C, GLU419B, GLU419C, GLU53B, GLU53C, GLY12B, GLY12C, GLY13B, GLY13C, GLY201B, GLY201C, GLY202B, GLY202C, GLY205B, GLY205C, GLY273B, GLY273C, GLY389B, GLY389C, GLY398B, GLY398C, GLY45B, GLY45C, GLY73B, GLY73C, GLY74B, GLY74C, GLY77B, GLY77C, HIS291B, HIS291C, HIS304B, HIS304C, HIS70B, HIS70C, ILE163B, ILE163C, ILE174B, ILE174C, ILE186B, ILE186C, ILE18B, ILE18C, ILE305B, ILE305C, ILE387B, ILE387C, ILE47B, ILE47C, LEU168B, LEU168C, LEU172B, LEU172C, LEU187B, LEU187C, LEU203B, LEU203C, LEU298B, LEU298C, LEU386B, LEU386C, LEU399B, LEU399C, LEU420C, LYS141B, LYS141C, LYS161B, LYS161C, LYS175B, LYS175C, LYS183B, LYS183C, LYS289B, LYS289C, LYS404B, LYS404C, LYS51B, LYS51C, LYS82B, LYS82C, MET177B, MET177C, MET190B, MET190C, PHE185B, PHE185C, PHE392B, PHE392C, PHE395B, PHE395C, PHE76B, PHE76C, PRO211C, PRO276B, PRO276C, PRO385B, PRO385C, PRO393B, PRO393C, PRO394B, PRO394C, PRO400B, PRO400C, PRO72B, PRO72C, SER11B, SER11C, SER166B, SER166C, SER171B, SER171C, SER176B, SER176C, SER181B, SER181C, SER207B, SER207C, SER307B, SER307C, SER78B, SER78C, THR15B, THR15C, THR165B, THR165C, THR167B, THR167C, THR180B, THR180C, THR182B, THR182C, THR71B, THR71C, TRP292B, TRP292C, TYR162B, TYR162C, TYR290B, TYR290C, TYR297B, TYR297C, TYR81B, TYR81C, VAL14B, VAL14C, VAL184B, VAL184C, VAL189B, VAL189C, VAL242B, VAL242C, VAL274B, VAL274C, VAL294B, VAL294C, VAL402B, VAL402C