3D5T

crystal structure of malate dehydrogenase from burkholderia pseudomallei

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 154
  • Norm. En. per Res.: -3.9779
• 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	-78.9793	-146.3642	-394.173	-619.5165	158	25	12	15773	6	57	27
B-C	0.0	0.3136	-19.8141	-19.5005	27	0	0	1015	0	27	25
C-D	-80.0758	-140.131	-392.394	-612.6008	154	24	14	15661	6	58	28

Interface residues

• A-B: ALA13A, ALA13B, ALA14A, ALA14B, ALA164A, ALA164B, ALA169A, ALA169B, ALA170A, ALA170B, ALA177A, ALA177B, ALA229A, ALA229B, ALA230A, ALA230B, ALA234A, ALA234B, ALA240A, ALA240B, ALA241A, ALA241B, ALA243A, ALA243B, ALA244A, ALA244B, ALA246A, ALA246B, ALA26A, ALA26B, ALA47A, ALA47B, ALA49A, ALA49B, ALA50A, ALA50B, ALA62A, ALA62B, ALA67A, ALA67B, ARG158A, ARG158B, ARG163A, ARG163B, ARG227A, ARG227B, ARG235A, ARG235B, ARG24A, ARG24B, ARG252A, ARG252B, ASN162A, ASN162B, ASN245A, ASN245B, ASN27A, ASN27B, ASP160A, ASP160B, ASP249A, ASP249B, ASP29A, ASP29B, ASP59A, ASP59B, ASP60A, ASP60B, CYS61A, CYS61B, GLN167A, GLN167B, GLN16A, GLN16B, GLN48A, GLN48B, GLU233A, GLU233B, GLU57A, GLU57B, GLY15A, GLY15B, GLY228A, GLY228B, GLY236A, GLY236B, GLY28A, GLY28B, GLY53A, GLY53B, HIS161A, HIS161B, ILE179A, ILE179B, ILE17A, ILE17B, ILE231A, ILE231B, ILE232A, ILE232B, ILE248A, ILE248B, LEU159A, LEU159B, LEU165A, LEU165B, LEU22A, LEU22B, LEU237A, LEU237B, LEU58A, LEU58B, LEU65A, LEU65B, LEU66A, LEU66B, LYS226B, LYS261A, LYS33A, LYS33B, LYS52A, LYS52B, MET56A, MET56B, PHE23A, PHE23B, PHE63A, PHE63B, PRO175A, PRO175B, PRO64A, PRO64B, SER166A, SER166B, SER178A, SER178B, SER20A, SER20B, SER238A, SER238B, SER239A, SER239B, SER242A, SER242B, THR223A, THR223B, TYR19A, TYR19B, VAL176A, VAL176B, VAL224A, VAL224B, VAL51A, VAL51B, VAL54A, VAL54B, VAL55A, VAL55B
• B-C: ALA145B, ALA323C, ARG294B, ASP101C, ASP124B, ASP147B, ASP270B, ASP320C, GLU108C, GLU277B, GLU288B, GLU291B, GLU98C, GLY290B, GLY321C, HIS324C, LEU148B, LEU325C, LYS100C, LYS150B, LYS151B, LYS293B, PRO146B, PRO149B, SER104C, TYR292B, VAL322C
• C-D: ALA13C, ALA13D, ALA14C, ALA14D, ALA164C, ALA164D, ALA169C, ALA169D, ALA170C, ALA170D, ALA177C, ALA177D, ALA229C, ALA229D, ALA230C, ALA230D, ALA234C, ALA234D, ALA240C, ALA240D, ALA241C, ALA241D, ALA243C, ALA243D, ALA244C, ALA244D, ALA246C, ALA246D, ALA26C, ALA26D, ALA47C, ALA47D, ALA49C, ALA49D, ALA50C, ALA50D, ALA62C, ALA62D, ALA67C, ALA67D, ARG158C, ARG158D, ARG163C, ARG163D, ARG227C, ARG227D, ARG235C, ARG235D, ARG24C, ARG24D, ARG252C, ARG252D, ASN162C, ASN162D, ASN245C, ASN245D, ASN27C, ASN27D, ASP160C, ASP160D, ASP249C, ASP249D, ASP29C, ASP29D, ASP59C, ASP59D, ASP60C, ASP60D, CYS61C, CYS61D, GLN167C, GLN167D, GLN16C, GLN16D, GLN48C, GLN48D, GLU233C, GLU233D, GLU57C, GLU57D, GLY15C, GLY15D, GLY228C, GLY228D, GLY236C, GLY236D, GLY28D, GLY53C, GLY53D, HIS161C, HIS161D, ILE179C, ILE179D, ILE17C, ILE17D, ILE231C, ILE231D, ILE232C, ILE232D, ILE248C, ILE248D, LEU159C, LEU159D, LEU165C, LEU165D, LEU22C, LEU22D, LEU237C, LEU237D, LEU58C, LEU58D, LEU65C, LEU65D, LEU66C, LEU66D, LYS33C, LYS33D, LYS52C, LYS52D, MET56C, MET56D, PHE23C, PHE23D, PHE63C, PHE63D, PRO175C, PRO175D, PRO64C, PRO64D, SER166C, SER166D, SER178C, SER178D, SER20C, SER20D, SER238C, SER238D, SER239C, SER239D, SER242C, SER242D, THR223C, TYR19C, TYR19D, VAL176C, VAL176D, VAL224C, VAL224D, VAL51C, VAL51D, VAL54C, VAL54D, VAL55C, VAL55D