1P1J

crystal structure of the 1l-myo-inositol 1-phosphate synthase complexed with nadh

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 456
  • Norm. En. per Res.: -4.8455
• 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	-441.9052	-81.3416	-1686.29	-2209.5368	456	77	66	67560	0	111	104

Interface residues

• A-B: ALA121A, ALA121B, ALA128A, ALA128B, ALA333A, ALA333B, ALA339A, ALA339B, ALA35A, ALA35B, ALA382A, ALA382B, ALA414A, ALA414B, ALA41B, ALA442A, ALA442B, ALA509A, ALA509B, ALA83A, ALA83B, ALA87A, ALA87B, ARG429A, ARG429B, ARG44A, ARG44B, ARG494A, ARG494B, ARG507A, ARG507B, ARG515A, ARG515B, ARG527A, ARG527B, ARG531A, ARG531B, ASN104A, ASN104B, ASN124A, ASN124B, ASN131A, ASN131B, ASN34A, ASN34B, ASN384A, ASN384B, ASN389A, ASN389B, ASN428A, ASN428B, ASN434A, ASN434B, ASN476A, ASN476B, ASN501A, ASN501B, ASN504A, ASN504B, ASN512A, ASN512B, ASN524A, ASN524B, ASN88A, ASN88B, ASP120A, ASP120B, ASP125A, ASP125B, ASP17A, ASP17B, ASP338A, ASP338B, ASP379A, ASP379B, ASP385A, ASP385B, ASP416A, ASP416B, ASP438A, ASP438B, ASP448A, ASP448B, ASP46A, ASP46B, ASP53A, CYS112A, CYS112B, CYS19A, CYS19B, CYS436A, CYS436B, GLN102A, GLN102B, GLN111A, GLN111B, GLN325A, GLN325B, GLN334A, GLN334B, GLN506A, GLN506B, GLN523A, GLN523B, GLN52A, GLN52B, GLU122A, GLU122B, GLU165A, GLU165B, GLU310A, GLU310B, GLU33A, GLU33B, GLU417A, GLU417B, GLU421A, GLU421B, GLU437A, GLU437B, GLU475A, GLU475B, GLU511A, GLU511B, GLU525A, GLU525B, GLU529A, GLU529B, GLU530A, GLU530B, GLU93A, GLU93B, GLU98A, GLU98B, GLY107A, GLY107B, GLY118A, GLY118B, GLY123A, GLY123B, GLY313A, GLY313B, GLY324A, GLY324B, GLY340A, GLY340B, GLY393A, GLY393B, GLY425A, GLY425B, GLY426A, GLY426B, GLY43A, GLY43B, GLY496A, GLY496B, GLY502A, GLY502B, GLY519A, GLY519B, HIS427A, HIS427B, HIS433A, HIS433B, HIS498A, HIS498B, ILE119A, ILE119B, ILE341A, ILE341B, ILE380A, ILE380B, ILE381A, ILE386A, ILE386B, ILE430A, ILE430B, ILE432A, ILE432B, ILE446A, ILE446B, ILE447A, ILE447B, ILE518A, ILE518B, ILE9A, LEU115A, LEU115B, LEU117A, LEU117B, LEU133A, LEU133B, LEU164A, LEU164B, LEU168A, LEU168B, LEU172A, LEU172B, LEU328A, LEU328B, LEU332A, LEU332B, LEU336A, LEU336B, LEU387A, LEU387B, LEU392A, LEU392B, LEU422A, LEU422B, LEU424A, LEU424B, LEU440A, LEU440B, LEU441A, LEU441B, LEU445A, LEU445B, LEU481A, LEU481B, LEU484A, LEU484B, LEU492A, LEU492B, LEU503A, LEU503B, LEU510A, LEU510B, LEU514A, LEU514B, LEU516A, LEU516B, LEU517A, LEU517B, LEU520A, LEU520B, LEU526A, LEU526B, LEU532A, LEU532B, LEU533A, LEU533B, LEU81A, LEU81B, LEU86A, LEU86B, LYS101A, LYS101B, LYS116A, LYS116B, LYS13A, LYS13B, LYS18A, LYS18B, LYS322A, LYS322B, LYS327A, LYS327B, LYS329A, LYS329B, LYS342A, LYS342B, LYS391A, LYS391B, LYS39A, LYS39B, LYS412A, LYS412B, LYS462A, LYS462B, LYS463A, LYS463B, LYS473A, LYS473B, LYS505A, LYS505B, LYS97B, MET109A, MET109B, MET415A, MET415B, MET423A, MET423B, PHE106A, PHE106B, PHE130A, PHE130B, PHE315A, PHE315B, PHE335A, PHE335B, PHE45A, PHE45B, PHE474A, PHE477A, PHE477B, PHE483A, PHE483B, PHE497A, PHE497B, PHE513A, PHE513B, PHE528A, PHE528B, PHE56A, PHE56B, PHE94A, PHE94B, PRO103A, PRO103B, PRO129A, PRO129B, PRO139A, PRO139B, PRO444A, PRO444B, PRO479A, PRO479B, PRO491A, PRO491B, PRO495A, PRO495B, PRO499A, PRO499B, PRO49A, PRO49B, PRO521A, PRO521B, SER108A, SER108B, SER113A, SER113B, SER11A, SER11B, SER132A, SER132B, SER31A, SER31B, SER323A, SER323B, SER330A, SER330B, SER383A, SER383B, SER411A, SER411B, SER420A, SER420B, SER42A, SER42B, SER431A, SER431B, SER439A, SER439B, SER460A, SER460B, SER485A, SER485B, SER522A, SER522B, SER84A, SER84B, THR10A, THR10B, THR110A, THR110B, THR114A, THR114B, THR16A, THR16B, THR326A, THR326B, THR38A, THR38B, THR40A, THR40B, THR443A, THR443B, THR482A, THR482B, THR48A, THR48B, THR493A, THR493B, THR508A, THR508B, THR50A, THR50B, THR80A, THR80B, THR96A, THR96B, TRP487A, TRP487B, TYR105A, TYR105B, TYR127A, TYR127B, TYR30A, TYR30B, TYR32A, TYR32B, TYR388A, TYR388B, TYR418A, TYR418B, TYR419A, TYR419B, TYR461A, TYR461B, TYR478A, TYR478B, TYR486A, TYR486B, TYR54A, TYR54B, VAL126A, VAL126B, VAL12A, VAL12B, VAL14A, VAL14B, VAL15A, VAL15B, VAL163A, VAL163B, VAL331A, VAL331B, VAL337A, VAL337B, VAL344A, VAL344B, VAL36A, VAL36B, VAL37A, VAL37B, VAL435A, VAL435B, VAL459A, VAL459B, VAL47A, VAL47B, VAL480A, VAL480B, VAL500A, VAL500B, VAL51A, VAL51B, VAL55A, VAL55B, VAL82A, VAL82B, VAL85A, VAL85B, VAL92A, VAL92B