1U0M

crystal structure of 1,3,6,8-tetrahydroxynaphthalene synthase (thns) from streptomyces coelicolor a3(2): a bacterial type iii polyketide synthase (pks) provides insights into enzymatic control of reactive polyketide intermediates

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 206
  • Norm. En. per Res.: -3.3776
• 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	-66.3895	-17.6805	-611.716	-695.7859	206	40	15	25676	5	45	51

Interface residues

• A-B: ALA116A, ALA116B, ALA134A, ALA134B, ALA139A, ALA139B, ALA140A, ALA140B, ALA143A, ALA143B, ALA154A, ALA154B, ALA228A, ALA228B, ALA249A, ALA249B, ALA305A, ALA305B, ALA339A, ALA339B, ARG129A, ARG129B, ARG147A, ARG147B, ARG209A, ARG209B, ARG68A, ASN120A, ASN120B, ASN146A, ASN146B, ASN210A, ASN210B, ASN69A, ASN69B, ASP125A, ASP125B, ASP150A, ASP150B, ASP220A, ASP220B, ASP225A, ASP225B, ASP67A, ASP67B, ASP99A, ASP99B, CYS106A, CYS106B, CYS138A, CYS138B, CYS152A, CYS152B, GLN130A, GLN130B, GLN135A, GLN135B, GLU121A, GLU121B, GLU166A, GLU166B, GLU208A, GLU219A, GLU219B, GLU252A, GLU252B, GLU256A, GLU340A, GLU340B, GLU66A, GLU66B, GLU73A, GLU73B, GLY108A, GLY108B, GLY137A, GLY137B, GLY211A, GLY211B, GLY230A, GLY230B, GLY334A, GLY334B, GLY336A, GLY336B, GLY64A, GLY64B, HIS149A, HIS149B, HIS232A, HIS232B, HIS62A, HIS62B, ILE101A, ILE102A, ILE102B, ILE119A, ILE119B, ILE131A, ILE131B, ILE133A, ILE133B, ILE215A, ILE215B, ILE222A, ILE222B, ILE337A, ILE337B, LEU114A, LEU114B, LEU118A, LEU118B, LEU136A, LEU136B, LEU207A, LEU214A, LEU214B, LEU234A, LEU234B, LEU253A, LEU253B, LYS217A, LYS217B, LYS227A, LYS227B, LYS70A, LYS70B, LYS77A, LYS77B, MET110A, MET110B, MET111A, MET111B, MET223A, MET223B, MET341A, MET341B, PHE109A, PHE109B, PHE124A, PHE124B, PHE151A, PHE151B, PHE231A, PHE231B, PHE233A, PHE233B, PHE65A, PHE65B, PRO112A, PRO112B, PRO132A, PRO132B, PRO156A, PRO156B, PRO216A, PRO216B, PRO335A, PRO335B, PRO63A, PRO63B, SER105A, SER105B, SER113A, SER113B, SER126A, SER126B, SER212A, SER212B, SER306A, THR107A, THR107B, THR115A, THR115B, THR127A, THR127B, THR128A, THR128B, THR153A, THR153B, THR218A, THR218B, THR229A, THR229B, THR338A, THR338B, TRP117A, TRP117B, TRP221A, TRP221B, TYR103A, TYR103B, TYR155A, TYR155B, TYR213A, TYR213B, TYR224A, TYR224B, TYR72A, TYR72B, VAL100A, VAL100B, VAL104A, VAL104B, VAL226A, VAL226B