3M5V

crystal structure of dihydrodipicolinate synthase from campylobacter jejuni

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 92
  • Norm. En. per Res.: -3.2028
• 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-C	-34.4596	20.9596	-383.339	-396.839	138	6	10	16215	0	26	31
A-D	-39.3112	-20.4645	-234.883	-294.6586	92	13	12	9874	2	34	41
B-C	-36.1336	-16.0873	-237.565	-289.7858	94	11	12	9758	0	33	40
B-D	-40.7459	26.9371	-394.614	-408.4228	137	10	10	16439	0	26	31

Interface residues

• A-C: ALA108A, ALA108C, ALA125A, ALA125C, ALA168C, ALA52A, ALA52C, ALA85A, ALA85C, ALA89A, ALA89C, ARG142A, ARG142C, ARG272A, ARG272C, ASN112A, ASN112C, ASN138A, ASN138C, ASN252A, ASN252C, ASN282A, ASN282C, ASN84A, ASN84C, CYS145A, CYS145C, CYS249A, CYS249C, CYS276A, CYS276C, GLN116A, GLN116C, GLN117A, GLN117C, GLU121A, GLU121C, GLU250A, GLU250C, GLU50A, GLU50C, GLU58A, GLU58C, GLU88A, GLU88C, GLY118A, GLY118C, GLY141A, GLY141C, GLY144A, GLY144C, GLY46A, GLY46C, GLY82A, GLY82C, HIS122A, HIS122C, HIS56A, HIS56C, HIS87A, HIS87C, ILE126A, ILE126C, ILE254A, ILE254C, LEU105A, LEU105C, LEU119A, LEU119C, LEU273A, LEU273C, LEU275A, LEU275C, LEU54A, LEU54C, LYS113A, LYS113C, LYS124A, LYS124C, LYS166A, LYS166C, PHE248A, PHE248C, PRO109A, PRO109C, PRO114A, PRO114C, PRO140A, PRO140C, PRO253A, PRO253C, PRO255A, PRO255C, PRO274A, PRO274C, PRO278A, PRO278C, SER251A, SER251C, SER277A, SER277C, SER279A, SER279C, SER51A, SER51C, SER83A, SER83C, THR115A, THR115C, THR143A, THR143C, THR47A, THR47C, THR48A, THR48C, THR53A, THR53C, THR55A, THR55C, THR86A, THR86C, TYR110A, TYR110C, TYR111A, TYR111C, TYR120A, TYR120C, TYR123A, TYR123C, TYR137A, TYR137C, VAL107A, VAL107C, VAL139A, VAL139C, VAL45A, VAL90A, VAL90C
• A-D: ALA180A, ALA180D, ALA193A, ALA193D, ASN171A, ASN171D, ASN195A, ASN195D, ASN201A, ASN201D, ASN229A, ASN229D, ASN237A, ASN237D, ASN242A, ASN242D, ASN244A, ASN244D, ASP150A, ASP150D, ASP173A, ASP173D, ASP177A, ASP177D, ASP192A, ASP192D, ASP238A, ASP238D, CYS175A, CYS175D, GLU191A, GLU191D, GLU228A, GLU228D, GLU239A, GLU239D, GLY170A, GLY170D, GLY202A, GLY202D, GLY203A, GLY203D, HIS181A, HIS181D, ILE172A, ILE172D, ILE194A, ILE194D, ILE198A, ILE198D, ILE243A, LEU178A, LEU178D, LEU179A, LEU179D, LEU187A, LEU187D, LEU199A, LEU199D, LEU240A, LEU240D, LYS174A, LYS174D, LYS204A, LYS204D, LYS231A, LYS231D, LYS234A, LYS234D, LYS235A, LYS235D, LYS245A, LYS245D, PRO183A, PRO183D, PRO197A, PRO197D, SER169A, SER169D, SER200A, SER200D, THR149A, THR149D, TYR196A, TYR196D, TYR230A, TYR230D, TYR241A, TYR241D, TYR293A, VAL176A, VAL176D
• B-C: ALA180B, ALA180C, ALA193B, ALA193C, ALA233C, ASN171B, ASN171C, ASN195B, ASN195C, ASN201B, ASN201C, ASN229B, ASN229C, ASN237B, ASN237C, ASN242B, ASN242C, ASN244B, ASN244C, ASP150B, ASP150C, ASP173B, ASP173C, ASP177B, ASP177C, ASP192B, ASP192C, ASP238B, ASP238C, CYS175B, CYS175C, GLU191B, GLU191C, GLU228B, GLU228C, GLU239B, GLU239C, GLY170B, GLY170C, GLY202B, GLY202C, GLY203B, GLY203C, HIS181B, HIS181C, ILE172B, ILE172C, ILE194B, ILE194C, ILE198B, ILE198C, ILE243C, LEU178B, LEU178C, LEU179B, LEU179C, LEU187B, LEU187C, LEU199B, LEU199C, LEU240B, LEU240C, LYS174B, LYS174C, LYS204B, LYS204C, LYS231B, LYS231C, LYS234B, LYS234C, LYS235B, LYS235C, LYS245B, LYS245C, PRO183B, PRO183C, PRO197B, PRO197C, SER169B, SER169C, SER200B, SER200C, THR149B, THR149C, TYR196B, TYR196C, TYR230B, TYR230C, TYR241B, TYR241C, TYR293B, TYR293C, VAL176B, VAL176C
• B-D: ALA108B, ALA108D, ALA125B, ALA125D, ALA168D, ALA52B, ALA52D, ALA85B, ALA85D, ALA89B, ALA89D, ARG142B, ARG142D, ARG272B, ARG272D, ASN112B, ASN112D, ASN138B, ASN138D, ASN252B, ASN252D, ASN282B, ASN282D, ASN84B, ASN84D, CYS145B, CYS145D, CYS249B, CYS249D, CYS276B, CYS276D, GLN116B, GLN116D, GLN117B, GLN117D, GLU121B, GLU121D, GLU250B, GLU250D, GLU50B, GLU50D, GLU58B, GLU58D, GLU88B, GLU88D, GLY118B, GLY118D, GLY141B, GLY141D, GLY144B, GLY144D, GLY46B, GLY46D, GLY82B, HIS122B, HIS122D, HIS56B, HIS56D, HIS87B, HIS87D, ILE126B, ILE126D, ILE254B, ILE254D, LEU105B, LEU105D, LEU119B, LEU119D, LEU273B, LEU273D, LEU275B, LEU275D, LEU54B, LEU54D, LYS113B, LYS113D, LYS124B, LYS124D, LYS166B, LYS166D, PHE17D, PHE248B, PHE248D, PRO109B, PRO109D, PRO114B, PRO114D, PRO140B, PRO140D, PRO253B, PRO253D, PRO255B, PRO255D, PRO274B, PRO274D, PRO278B, PRO278D, SER251B, SER251D, SER277B, SER277D, SER279B, SER279D, SER51B, SER51D, SER83B, SER83D, THR115B, THR115D, THR143B, THR143D, THR47B, THR47D, THR48B, THR48D, THR53B, THR53D, THR55B, THR55D, THR86B, THR86D, TYR110B, TYR110D, TYR111B, TYR111D, TYR120B, TYR120D, TYR123B, TYR123D, TYR137B, TYR137D, VAL107B, VAL107D, VAL139B, VAL139D, VAL90B, VAL90D