2PKF

crystal structure of m tuberculosis adenosine kinase (apo)

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 94
  • Norm. En. per Res.: -3.4913
• 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	-23.9061	-30.7143	-273.559	-328.1794	94	12	6	9154	2	28	31

Interface residues

• A-B: ALA100A, ALA10A, ALA114A, ALA120A, ALA124A, ALA130B, ALA135B, ALA146A, ALA151A, ALA175A, ALA50A, ARG101A, ARG125A, ARG176A, ARG183A, ARG184A, ASN147A, ASN52A, ASN87B, ASP-6B, ASP12A, ASP131B, ASP148A, ASP218B, ASP89B, CYS104A, GLN-2B, GLN172A, GLN173A, GLU-7B, GLU123A, GLU140B, GLU150A, GLU180A, GLU181A, GLU198A, GLU63B, GLY-9B, GLY119A, GLY137B, GLY145A, GLY179A, GLY207A, GLY254A, GLY47A, GLY48A, GLY7A, HIS0B, HIS13A, HIS31A, HIS90B, ILE136B, ILE182A, ILE217B, ILE9A, LEU-5B, LEU14A, LEU174A, LEU177A, LEU201A, LYS138B, LYS205A, LYS82B, MET121A, MET152A, MET1B, PHE-3B, PHE102A, PHE116A, PRO118A, PRO139B, PRO149A, PRO170A, PRO234B, SER115A, SER122A, SER134B, SER171A, SER178A, SER204A, SER8A, THR-8B, THR103A, THR11A, THR206A, THR253A, THR2B, THR99A, TYR-4B, TYR117A, TYR197A, VAL132B, VAL133B, VAL49A