3FIW

structure of sco0253, a tetr-family transcriptional regulator from streptomyces coelicolor

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 4
  • Norm. En. per Res.: -10.9512
• 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	-86.1552	-332.0706	-650.664	-1068.8899	154	32	31	25536	18	68	56
A-C	0.0	-3.1793	-6.4968	-9.6761	30	0	0	794	0	13	22
A-D	-16.0082	-19.3915	-7.0402	-42.44	6	1	0	159	2	3	1
B-C	-18.7727	-20.6513	-4.3808	-43.8048	4	1	0	121	2	3	1
C-D	-59.9427	-281.4764	-648.706	-990.1251	151	31	30	25159	13	71	59

Interface residues

• A-B: ALA101A, ALA101B, ALA121B, ALA129A, ALA129B, ALA132A, ALA132B, ALA135A, ALA135B, ALA136A, ALA136B, ALA149A, ALA149B, ALA171A, ALA171B, ALA174A, ALA174B, ALA177A, ALA177B, ALA189A, ALA97A, ALA97B, ARG104A, ARG104B, ARG127A, ARG127B, ARG138A, ARG138B, ARG185A, ARG185B, ARG190A, ARG49B, ARG81A, ARG81B, ARG84A, ARG84B, ARG87A, ARG87B, ARG88A, ARG88B, ARG98A, ARG98B, ASN82A, ASN82B, ASP167A, ASP167B, ASP181A, ASP181B, ASP188A, ASP23A, CYS143A, CYS143B, GLN130A, GLN130B, GLN148A, GLN148B, GLU126A, GLU146A, GLU146B, GLU147A, GLU147B, GLU150A, GLU150B, GLU169A, GLU169B, GLU173A, GLU173B, GLY102A, GLY102B, GLY123A, GLY123B, GLY137A, GLY137B, GLY142A, GLY142B, GLY175A, GLY175B, GLY182A, GLY182B, GLY77A, GLY77B, HIS100A, HIS100B, HIS128A, HIS128B, HIS168A, HIS168B, HIS186A, HIS186B, HIS76A, HIS76B, ILE166A, ILE166B, ILE179A, ILE179B, LEU119A, LEU119B, LEU134A, LEU134B, LEU145A, LEU145B, LEU176A, LEU176B, LEU178A, LEU178B, LEU183A, LEU183B, LEU80A, LEU80B, LEU90A, LEU90B, LEU91A, LEU91B, LYS48B, PHE139A, PHE139B, PHE172A, PHE172B, PHE79A, PHE79B, PHE86A, PHE86B, PRO105B, PRO125A, PRO125B, SER103A, SER103B, SER122A, SER122B, SER170A, SER170B, SER85A, SER85B, THR140A, THR140B, THR180A, THR180B, THR83A, THR83B, TRP75A, TRP75B, TRP78A, TRP78B, VAL120B, VAL124A, VAL124B, VAL141A, VAL141B, VAL144A, VAL144B, VAL184A, VAL184B, VAL187A, VAL187B
• A-C: ALA61A, ALA65A, ALA65C, ARG84A, ARG84C, ARG87A, ARG87C, ARG88A, ARG88C, ARG93C, ASN5A, ASN5C, CB7.919977.33051, GLU147A, GLU66A, GLU66C, GLU7A, GLU7C, LEU91A, LEU91C, LYS3A, LYS3A5, LYS3C, PRO62A, PRO62C, PRO67C, SER85C, THR11A, THR8A, THR8C
• A-D: CB8.71750-38.78310, GLU169D, GLU173D, LYS3A, LYS3A5, PHE172D
• B-C: GLU169B, GLU173B, LYS3C, PHE172B
• C-D: ALA101C, ALA101D, ALA121D, ALA129C, ALA129D, ALA132C, ALA132D, ALA135C, ALA135D, ALA136C, ALA136D, ALA149C, ALA149D, ALA171C, ALA171D, ALA174C, ALA174D, ALA177C, ALA177D, ALA189C, ALA97C, ALA97D, ARG104C, ARG104D, ARG127C, ARG127D, ARG138C, ARG138D, ARG185C, ARG185D, ARG190C, ARG81C, ARG81D, ARG84C, ARG84D, ARG87C, ARG87D, ARG88C, ARG88D, ARG98C, ARG98D, ASN82C, ASN82D, ASP167C, ASP167D, ASP181C, ASP181D, ASP188C, ASP188D, CYS143C, CYS143D, GLN130C, GLN130D, GLN148C, GLN148D, GLU126C, GLU146C, GLU146D, GLU147C, GLU147D, GLU150C, GLU150D, GLU169C, GLU169D, GLU173C, GLU173D, GLY102C, GLY102D, GLY123C, GLY123D, GLY137C, GLY137D, GLY142C, GLY142D, GLY175C, GLY175D, GLY182C, GLY182D, GLY77C, GLY77D, HIS100C, HIS100D, HIS128C, HIS128D, HIS168C, HIS168D, HIS186C, HIS186D, HIS76C, HIS76D, ILE166D, ILE179C, ILE179D, LEU119C, LEU119D, LEU134C, LEU134D, LEU145C, LEU145D, LEU176C, LEU176D, LEU178C, LEU178D, LEU183C, LEU183D, LEU80C, LEU80D, LEU90C, LEU90D, LEU91C, LEU91D, PHE139C, PHE139D, PHE172C, PHE172D, PHE79C, PHE79D, PHE86C, PHE86D, PRO125C, PRO125D, SER103C, SER103D, SER122C, SER122D, SER170C, SER170D, SER85C, SER85D, THR140C, THR140D, THR180C, THR180D, THR83C, THR83D, TRP75C, TRP75D, TRP78C, TRP78D, VAL120C, VAL120D, VAL124C, VAL124D, VAL141C, VAL141D, VAL144C, VAL144D, VAL184C, VAL184D, VAL187C, VAL187D