2O4M

structure of phosphotriesterase mutant i106g/f132g/h257y

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 120
  • Norm. En. per Res.: -5.6808
• 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	-70.9913	-163.0171	-447.687	-681.6954	120	14	7	15343	9	26	29
A-P	-19.204	30.6435	-122.964	-111.5246	82	10	2	5248	0	17	23
B-P	0.0	-3.7915	-0.6002	-4.3917	13	0	0	194	0	4	5
C-P	-58.3526	-135.6863	-442.642	-636.6808	121	14	7	15067	10	28	29

Interface residues

• A-B: ALA63A, ALA63B, ALA68A, ALA68B, ARG108A, ARG108B, ARG139A, ARG139B, ARG141A, ARG141B, ARG152A, ARG152B, ARG67A, ARG67B, ARG76A, ARG76B, ASN312A, ASN312B, ASP105A, ASP105B, ASP133A, ASP133B, ASP160A, ASP160B, GLN148A, GLN148B, GLU144A, GLU144B, GLU145A, GLU145B, GLU153A, GLU153B, GLU159A, GLU159B, GLU71A, GLU71B, GLY106A, GLY106B, GLY107A, GLY107B, GLY132A, GLY132B, GLY157A, GLY157B, GLY60A, GLY60B, GLY64A, GLY64B, ILE158A, ILE158B, ILE313A, ILE313B, LEU130A, LEU130B, LEU136A, LEU136B, LEU140A, LEU140B, LEU146A, LEU146B, LEU66A, LEU66B, MET138A, MET138B, PHE104A, PHE104B, PHE149A, PHE149B, PHE150A, PHE150B, PHE179A, PHE179B, PHE306A, PHE306B, PHE65A, PHE65B, PHE72A, PHE72B, PHE73A, PHE73B, PRO134A, PRO134B, PRO135A, PRO135B, PRO70A, PRO70B, SER137A, SER137B, SER142A, SER142B, SER267A, SER267B, SER307A, SER307B, SER308A, SER308B, SER61A, SER61B, SER62A, SER62B, SER75A, SER75B, THR128B, THR147A, THR147B, THR161A, THR161B, THR311A, THR311B, TRP131A, TRP131B, TRP69A, TRP69B, TYR156A, TYR156B, TYR309A, TYR309B, VAL143A, VAL310A, VAL310B
• A-P: ALA114A, ALA190A, ALA193A, ALA326P, ALA347P, ALA90P, ALA92P, ALA93P, ARG118A, ARG152A, ARG164A, ARG189A, ARG331P, ARG337P, ARG363A, ARG36A, ARG41A, ARG85P, ARG88P, ARG89P, ARG91P, ARG96P, ASN38A, ASP121P, ASP160A, ASP323P, ASP35A, ASP35A9, CB9.5549044.53552, GLN148A, GLN155A, GLN343P, GLU153A, GLU159A, GLU338P, GLU344P, GLU48P, GLY157A, GLY162A, GLY195A, GLY348P, GLY34A, GLY42A, GLY50P, GLY86P, GLY94P, ILE154A, ILE158A, ILE163A, ILE328P, ILE333P, LEU151A, LEU192A, LEU330P, LEU346P, LEU362A, LEU87P, PHE149A, PHE150A, PHE335P, PHE51P, PRO322P, PRO329P, PRO334P, PRO342P, PRO360A, PRO43A, SER191A, THR147A, THR161A, THR194A, THR345P, THR350P, THR361A, THR39A, TYR156A, VAL196A, VAL332P, VAL351P, VAL40A, VAL84P, VAL95P
• B-P: ALA347P, ARG76B, GLN343P, GLU344P, GLU71B, GLU81B, LYS294P, LYS77B, MET293P, PRO70B, SER75B, THR352P, VAL351P
• C-P: ALA63C, ALA63P, ALA68C, ALA68P, ARG108C, ARG108P, ARG139C, ARG139P, ARG141C, ARG141P, ARG152C, ARG152P, ARG67C, ARG67P, ARG76C, ARG76P, ASN312C, ASN312P, ASP105C, ASP105P, ASP133C, ASP133P, ASP160C, ASP160P, CYS59C, GLN148C, GLN148P, GLU144C, GLU144P, GLU145C, GLU145P, GLU153C, GLU153P, GLU159C, GLU159P, GLU71C, GLU71P, GLY106C, GLY106P, GLY107C, GLY107P, GLY132C, GLY132P, GLY157C, GLY157P, GLY60C, GLY60P, GLY64C, GLY64P, ILE158C, ILE158P, ILE313C, ILE313P, LEU130C, LEU130P, LEU136C, LEU136P, LEU140C, LEU140P, LEU146C, LEU146P, LEU66C, LEU66P, MET138C, MET138P, PHE104C, PHE104P, PHE149C, PHE149P, PHE150C, PHE150P, PHE179C, PHE179P, PHE306C, PHE306P, PHE65C, PHE65P, PHE72C, PHE72P, PHE73C, PHE73P, PRO134C, PRO134P, PRO135C, PRO135P, PRO70C, PRO70P, SER137C, SER137P, SER142C, SER142P, SER267C, SER267P, SER307C, SER307P, SER308C, SER308P, SER61C, SER61P, SER62C, SER62P, SER75C, SER75P, THR147C, THR147P, THR161C, THR161P, THR311C, THR311P, TRP131C, TRP131P, TRP69C, TRP69P, TYR156C, TYR156P, TYR309C, TYR309P, VAL143C, VAL143P, VAL310C, VAL310P