3NE9

mycobacterium tuberculosis acyl carrier protein synthase adopts two different structural conformations: ph driven conformational changes of acps enzyme

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 99
  • Norm. En. per Res.: -3.7273
• Hub Node: A(2)

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	-52.1493	-2.5367	-161.74	-216.4259	94	33	9	9917	3	26	23
A-C	-81.547	-10.3109	-277.144	-369.0019	99	22	10	10001	4	24	23
B-C	-52.7186	-5.1729	-257.473	-315.3644	94	29	8	9967	3	25	22

Interface residues

• A-B: ALA112A, ALA133A, ALA143A, ALA143B, ALA145A, ALA145B, ALA71A, ALA71B, ALA75B, ALA79B, ALA7B, ALA83B, ARG107A, ARG110A, ARG150A, ARG150B, ARG153B, ARG5B, ARG69A, ASP106A, ASP129A, ASP139A, ASP13A, ASP13B, ASP141A, ASP141B, CYS147A, CYS147B, GLN114A, GLN23B, GLN82B, GLU131A, GLU6A, GLU6B, GLU74B, GLU92B, GLY109A, GLY11A, GLY11B, GLY140A, GLY19B, GLY86B, HIS138A, HIS16A, HIS16B, ILE136A, ILE17A, ILE17B, ILE77B, ILE84B, ILE91B, LEU104A, LEU113A, LEU132A, LEU134A, LEU146A, LEU146B, LEU148A, LEU148B, LEU149B, LEU14A, LEU14B, LYS78B, LYS87B, PHE20B, PRO105A, PRO18A, PRO18B, PRO88B, PRO89B, PRO93B, SER135A, SER137A, SER81B, THR144A, THR144B, THR9B, TRP108A, TRP70B, TRP80B, TYR142A, TYR142B, TYR151B, TYR85B, VAL103A, VAL10A, VAL10B, VAL111A, VAL12A, VAL12B, VAL130A, VAL15A, VAL15B, VAL90B
• A-C: ALA112C, ALA133C, ALA143A, ALA143C, ALA145A, ALA145C, ALA71A, ALA75A, ALA79A, ALA7A, ALA83A, ARG107C, ARG110C, ARG150A, ARG150C, ARG153A, ARG5A, ARG5A5, ARG5C, ARG69C, ASP106C, ASP129C, ASP139C, ASP13A, ASP13C, ASP141A, ASP141C, CB8.85565-33.75174, CB8.93043-34.17912, CB9.7166225.24861, CYS147A, CYS147C, GLN114C, GLN152C, GLN23A, GLN82A, GLU131C, GLU6A, GLU6C, GLU74A, GLU92A, GLY109C, GLY11A, GLY11C, GLY140C, GLY19A, GLY86A, HIS138C, HIS16A, HIS16C, ILE136C, ILE17A, ILE17C, ILE77A, ILE84A, ILE91A, LEU104C, LEU113C, LEU132C, LEU134C, LEU146A, LEU146C, LEU148A, LEU148C, LEU149A, LEU14A, LEU14C, LYS78A, LYS87A, PHE20A, PRO105C, PRO18A, PRO18C, PRO88A, PRO89A, PRO93A, SER135C, SER137C, SER81A, THR144A, THR144C, THR9A, TRP108C, TRP70A, TRP80A, TYR142A, TYR142C, TYR151A, TYR151C, TYR85A, VAL103C, VAL10A, VAL10C, VAL111C, VAL12A, VAL12C, VAL15A, VAL15C, VAL90A
• B-C: ALA112B, ALA133B, ALA143B, ALA143C, ALA145B, ALA145C, ALA71C, ALA75C, ALA79C, ALA7B, ALA7C, ALA83C, ARG107B, ARG110B, ARG150B, ARG150C, ARG153C, ARG5B, ARG5C, ARG69B, ASP106B, ASP139B, ASP13B, ASP13C, ASP141B, ASP141C, CYS147B, CYS147C, GLN114B, GLN152B, GLN23C, GLN82C, GLU131B, GLU6B, GLU6C, GLU74C, GLU92C, GLY109B, GLY11B, GLY11C, GLY140B, GLY19C, GLY86C, HIS138B, HIS16B, HIS16C, ILE136B, ILE17B, ILE17C, ILE77C, ILE84C, ILE91C, LEU104B, LEU113B, LEU132B, LEU134B, LEU146B, LEU146C, LEU148B, LEU148C, LEU149C, LEU14B, LEU14C, LYS78C, LYS87C, PHE20C, PRO105B, PRO18B, PRO18C, PRO88C, PRO89C, PRO93C, SER135B, SER137B, SER81C, THR144B, THR144C, THR9C, TRP108B, TRP70C, TRP80C, TYR142B, TYR142C, TYR151C, TYR85C, VAL103B, VAL10B, VAL10C, VAL111B, VAL12B, VAL12C, VAL15B, VAL15C, VAL90C