2Y85

crystal structure of mycobacterium tuberculosis phosphoribosyl isomerase with bound rcdrp

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 112
  • Norm. En. per Res.: -2.5527
• 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	-28.8917	13.0116	-270.027	-285.9071	112	14	3	10459	6	56	55
A-C	0.0	0.0	-42.5491	-42.5491	31	3	0	1774	0	13	8
A-D	-11.0711	-25.5684	-38.5087	-75.1482	45	7	0	2233	1	23	17
B-C	-9.4019	9.3826	-49.5077	-49.527	29	1	0	1866	0	10	10
C-D	-12.7008	-2.9094	-100.046	-115.6562	60	4	3	4580	0	17	9

Interface residues

• A-B: ALA106A, ALA106B, ALA231A, ALA231B, ALA56A, ALA56B, ALA57A, ALA57B, ARG139A, ARG139B, ARG141A, ARG141B, ARG143A, ARG143B, ARG16A, ARG16B, ARG19A, ARG19B, ARG233A, ARG233B, ARG60A, ARG60B, ARG85A, ARG85B, ASN63A, ASN63B, ASP11A, ASP11B, ASP135A, ASP135B, ASP148A, ASP148B, ASP151A, ASP171A, ASP175A, ASP175B, ASP53A, ASP53B, ASP55A, ASP55B, GLN132A, GLN132B, GLU109A, GLU109B, GLU137A, GLU146A, GLU146B, GLU14A, GLU14B, GLU30A, GLU30B, GLY136A, GLY136B, GLY142A, GLY142B, GLY144A, GLY144B, GLY149A, GLY149B, GLY150A, GLY150B, GLY176A, GLY176B, GLY179A, GLY179B, GLY180B, GLY202A, GLY59A, GLY59B, GLY61A, GLY61B, GLY83A, GLY83B, ILE133A, ILE133B, ILE134A, ILE134B, ILE172A, ILE172B, LEU140A, LEU178A, LEU178B, LEU20B, LEU54A, LEU54B, LYS174A, LYS174B, LYS227A, LYS227B, PHE58A, PHE58B, SER204A, SER204B, THR147A, THR147B, THR173A, THR173B, THR177A, THR177B, THR29A, THR29B, TRP145A, TRP145B, TYR31A, TYR31B, VAL12A, VAL12B, VAL13A, VAL13B, VAL18A, VAL18B, VAL21B
• A-C: ALA239C, ALA241C, ALA242C, ALA46C, ARG158A, ARG210C, ARG244C, ARG43C, ASN110A, ASP148A, ASP44C, ASP87A, CYS114A, GLN112A, GLN238C, GLU109A, GLU162A, GLY149A, GLY45C, LEU108A, LEU206C, LEU236C, LEU240C, LEU6C, PHE234C, PRO111A, PRO237C, THR147A, THR235C, TRP113A, TRP145A
• A-D: ALA115A, ALA231D, ALA37D, ALA91A, ARG116A, ARG158A, ARG19D, ARG232D, ARG43D, ASP123A, ASP160A, ASP36D, ASP44D, ASP87A, CYS114A, CYS164A, GLN112A, GLN238D, GLU120A, GLU162A, GLU30D, GLY119A, GLY122A, GLY163A, GLY32D, GLY40D, HIS121A, ILE118A, LEU20D, LEU229D, LEU39D, LEU90A, PHE234D, PRO111A, PRO237D, SER161A, SER165A, SER33D, THR235D, TRP113A, TRP41D, TYR230D, TYR31D, VAL117A, VAL35D
• B-C: ALA17B, ALA228C, ALA231C, ALA34B, ARG16B, ARG19B, ARG232C, ARG233C, ASN63B, ASP36B, GLN238C, GLU14B, GLU30B, GLY15B, GLY32B, LEU178C, LEU206C, LEU229C, LEU66B, PHE234C, SER204C, SER205C, SER33B, THR235C, THR29B, TYR230C, TYR31B, VAL13B, VAL18B
• C-D: ALA213D, ALA239D, ALA241C, ALA241D, ALA242D, ALA46C, ALA46D, ALA99C, ARG100C, ARG166C, ARG210D, ARG232D, ARG233D, ARG244C, ARG244D, ARG43C, ARG43D, ASP123C, ASP207D, ASP44C, ASP44D, ASP75C, CYS98C, GLN124C, GLN238D, GLN42C, GLN42D, GLN77C, GLU221C, GLU47C, GLU47D, GLY45C, GLY45D, GLY97C, ILE49C, ILE5C, LEU206D, LEU236C, LEU236D, LEU240C, LEU240D, LEU39C, LEU4C, LEU6C, LEU74C, LEU7C, MET2C, PHE234D, PRO196C, PRO237D, PRO3C, PRO3D, SER205D, THR235D, TRP41C, TRP48C, VAL243D, VAL71C, VAL76C, VAL78C