3TLX

crystal structure of pf10_0086, adenylate kinase from plasmodium falciparum

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 32
  • Norm. En. per Res.: -2.4957
• 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	-22.7383	30.7989	-81.6321	-73.5715	77	4	2	4088	0	25	37
A-C	-14.2037	0.0	-65.7962	-79.9999	33	3	4	2873	0	14	9
A-D	-4.4224	0.0	-37.5357	-41.9581	30	0	3	2266	0	4	4
B-C	0.0	0.0	-53.7199	-53.7199	32	0	3	2228	0	4	3
B-D	-11.1383	0.0	-68.7256	-79.8639	32	3	5	2802	0	20	11
C-D	0.0	-0.8182	-34.2194	-35.0376	59	0	2	2072	0	24	34

Interface residues

• A-B: ALA22A, ALA22B, ARG19B, ARG20A, ARG20B, ARG30A, ARG30B, ASN125A, ASN131A, ASN131B, ASN218A, ASN218B, ASN222B, ASP136A, ASP136B, ASP241A, ASP241B, ASP28A, ASP28B, CYS23A, CYS23B, GLN129A, GLN129B, GLN132A, GLN132B, GLU16B, GLY137A, GLY137B, GLY242A, GLY242B, GLY29A, GLY29B, HIS239A, HIS239B, ILE221A, ILE221B, ILE240A, ILE240B, LEU135A, LEU135B, LEU14A, LEU14B, LEU17A, LEU17B, LEU219A, LEU219B, LEU220B, LEU24A, LEU24B, LYS106A, LYS106B, LYS107A, LYS107B, LYS130A, LYS134A, LYS134B, LYS18B, LYS217A, LYS217B, LYS26A, LYS26B, PHE139B, PRO27A, PRO27B, SER25A, SER25B, THR10B, THR133A, THR133B, TYR21A, TYR21B, TYR31A, TYR31B, TYR54A, TYR54B, VAL138A, VAL138B
• A-C: ARG20A, ARG20C, ASN15A, ASN15C, ASN4C, ASN7C, ASP12A, ASP12C, GLU16A, GLU16C, GLU3C, GLU6C, ILE11A, ILE11C, LEU13A, LEU13C, LEU14A, LEU14C, LEU17A, LEU17C, LEU24A, LEU24C, LEU5C, LYS18A, PHE8A, PHE8C, SER9A, SER9C, THR10A, THR10C, TYR21A, TYR21C, VAL180A
• A-D: ALA22A, ALA22D, ARG19A, ARG19D, ARG20A, ARG20D, ASN15A, ASN15D, ASP12A, ASP12D, GLU16A, GLU16D, ILE11A, ILE11D, LEU13A, LEU13D, LEU14A, LEU14D, LEU17A, LEU17D, LEU24A, LEU24D, LYS18A, LYS18D, SER25A, SER25D, THR10A, THR10D, TYR21A, TYR21D
• B-C: ALA22B, ALA22C, ARG19B, ARG19C, ARG20B, ARG20C, ASN15B, ASN15C, ASP12B, ASP12C, GLU16B, GLU16C, ILE11B, ILE11C, LEU13B, LEU13C, LEU14B, LEU14C, LEU17B, LEU17C, LEU24B, LEU24C, LYS18B, LYS18C, SER25B, SER25C, SER9B, SER9C, THR10B, THR10C, TYR21B, TYR21C
• B-D: ARG20B, ARG20D, ASN15D, ASN4B, ASN7B, ASN7D, ASP12B, ASP12D, GLU16B, GLU16D, GLU3B, GLU6B, GLU6D, ILE11B, ILE11D, LEU13B, LEU13D, LEU14B, LEU14D, LEU17B, LEU17D, LEU24B, LEU24D, LEU5B, PHE8B, PHE8D, SER9B, SER9D, THR10B, THR10D, TYR21B, TYR21D
• C-D: ALA22C, ARG20C, ARG20D, ARG30D, ASN131C, ASN218D, ASP136C, ASP136D, ASP241D, ASP28C, ASP28D, CYS105C, CYS23C, CYS23D, GLN129C, GLN129D, GLN132C, GLY108C, GLY137D, GLY242D, GLY29C, GLY29D, HIS239D, ILE221D, ILE240D, LEU128C, LEU135C, LEU135D, LEU14C, LEU14D, LEU17C, LEU17D, LEU219C, LEU219D, LEU220D, LEU24C, LEU24D, LYS106C, LYS106D, LYS107C, LYS107D, LYS130C, LYS134C, LYS134D, LYS217D, LYS26C, LYS26D, PRO27C, PRO27D, SER25C, SER25D, THR10C, THR133C, THR133D, TYR21C, TYR21D, TYR31D, TYR54C, VAL138D