1UB7

the crystal analysis of beta-keroacyl-[acyl carrier protein] synthase iii (fabh)from thermus thermophilus.

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 230
  • Norm. En. per Res.: -4.8887
• 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	-234.5938	-45.2028	-844.605	-1124.4016	230	32	59	32374	6	35	28
A-D	-24.2733	88.6801	-98.5295	-34.1227	44	5	1	3267	8	32	27
C-D	-216.3916	-55.6151	-829.862	-1101.8687	232	43	59	32096	5	35	28

Interface residues

• A-B: ALA101A, ALA101B, ALA103A, ALA103B, ALA108A, ALA108B, ALA116A, ALA116B, ALA118A, ALA118B, ALA120A, ALA120B, ALA122A, ALA122B, ALA126A, ALA126B, ALA129A, ALA129B, ALA139A, ALA139B, ALA180A, ALA180B, ALA185A, ALA185B, ALA191A, ALA191B, ALA194A, ALA194B, ALA308A, ALA308B, ALA313A, ALA313B, ALA44A, ALA45A, ALA45B, ALA74A, ALA74B, ALA78A, ALA78B, ALA84A, ALA84B, ALA90A, ALA90B, ALA91A, ALA91B, ALA95A, ALA95B, ARG196A, ARG196B, ARG206A, ARG206B, ARG96A, ARG96B, ASN80A, ASN80B, ASP105A, ASP105B, ASP181A, ASP181B, ASP199A, ASP199B, ASP47A, ASP47B, ASP52A, ASP52B, ASP73A, ASP73B, ASP83A, ASP83B, ASP88A, ASP88B, CYS192A, CYS192B, GLN119A, GLN119B, GLN94A, GLN94B, GLU125A, GLU125B, GLU138A, GLU138B, GLU187A, GLU187B, GLU228A, GLU228B, GLU46A, GLU46B, GLU48A, GLU48B, GLY109A, GLY109B, GLY112A, GLY112B, GLY127A, GLY127B, GLY179A, GLY179B, GLY182A, GLY182B, GLY184A, GLY184B, GLY200B, GLY307A, GLY307B, GLY309A, GLY309B, GLY98A, GLY98B, HIS121A, HIS121B, HIS190A, HIS190B, ILE114A, ILE143A, ILE143B, ILE144A, ILE144B, ILE76A, ILE76B, LEU106A, LEU106B, LEU107A, LEU107B, LEU117A, LEU117B, LEU123A, LEU123B, LEU128A, LEU128B, LEU140A, LEU140B, LEU178A, LEU178B, LEU188A, LEU188B, LEU197A, LEU197B, LEU207A, LEU207B, LEU310A, LEU310B, LEU53A, LEU53B, LEU85A, LEU85B, LEU92A, LEU92B, LEU99A, LEU99B, LYS100A, LYS100B, LYS142A, LYS142B, LYS186A, LYS186B, LYS232A, LYS232B, LYS56A, MET203A, MET203B, MET209A, MET209B, PHE102A, PHE102B, PHE155A, PHE155B, PHE173A, PHE173B, PHE176A, PHE176B, PHE55A, PHE55B, PHE86A, PHE86B, PRO111A, PRO111B, PRO195A, PRO195B, PRO198A, PRO198B, PRO82A, PRO82B, PRO87A, PRO87B, SER141A, SER141B, SER175A, SER175B, SER278A, SER51A, SER51B, THR183A, THR183B, THR201A, THR311A, THR311B, THR50A, THR50B, THR79A, THR79B, THR81A, THR81B, THR89A, THR89B, TRP312A, TRP312B, TYR104A, TYR104B, TYR115A, TYR115B, TYR189A, TYR189B, TYR208A, TYR208B, TYR49A, TYR49B, VAL124A, VAL124B, VAL132A, VAL132B, VAL177A, VAL177B, VAL193A, VAL193B, VAL75A, VAL75B, VAL77A, VAL77B, VAL93A, VAL93B
• A-D: ALA289A, ALA289D, ALA292A, ALA292D, ARG241A, ARG241D, ARG266A, ARG266D, ARG294A, ARG294D, ARG296A, ARG296D, ARG64A, ARG64D, ASP291A, ASP291D, ASP299A, ASP299D, GLU265A, GLU265D, GLU288A, GLU297A, GLU297D, GLY293A, GLY293D, GLY298A, GLY298D, HIS300A, HIS300D, ILE295A, ILE295D, LEU242A, LEU242D, LYS287A, PRO263A, PRO263D, TRP264A, TRP264D, TRP319A, VAL267A, VAL267D, VAL290A, VAL290D, VAL301A
• C-D: ALA101C, ALA101D, ALA103C, ALA103D, ALA108C, ALA108D, ALA116C, ALA116D, ALA118C, ALA118D, ALA120C, ALA120D, ALA122C, ALA122D, ALA126C, ALA126D, ALA129C, ALA129D, ALA139C, ALA139D, ALA180C, ALA180D, ALA185C, ALA185D, ALA191C, ALA191D, ALA194C, ALA194D, ALA308C, ALA308D, ALA313C, ALA313D, ALA44D, ALA45C, ALA45D, ALA74C, ALA74D, ALA78C, ALA78D, ALA84C, ALA84D, ALA90C, ALA90D, ALA91C, ALA91D, ALA95C, ALA95D, ARG174C, ARG196C, ARG196D, ARG206C, ARG206D, ARG96C, ARG96D, ASN80C, ASN80D, ASP105C, ASP105D, ASP181C, ASP181D, ASP199C, ASP199D, ASP47C, ASP47D, ASP52C, ASP52D, ASP73C, ASP73D, ASP83C, ASP83D, ASP88C, ASP88D, CYS192C, CYS192D, GLN119C, GLN119D, GLN94C, GLN94D, GLU125C, GLU125D, GLU138C, GLU138D, GLU187C, GLU187D, GLU228C, GLU228D, GLU46C, GLU46D, GLU48C, GLU48D, GLY109C, GLY109D, GLY112C, GLY112D, GLY127C, GLY127D, GLY179C, GLY179D, GLY182C, GLY182D, GLY184C, GLY184D, GLY200C, GLY307C, GLY307D, GLY309C, GLY309D, GLY98C, GLY98D, HIS121C, HIS121D, HIS190C, HIS190D, ILE114C, ILE114D, ILE143C, ILE143D, ILE144C, ILE144D, ILE76C, ILE76D, LEU106C, LEU106D, LEU107C, LEU107D, LEU117C, LEU117D, LEU123C, LEU123D, LEU128C, LEU128D, LEU140C, LEU140D, LEU178C, LEU178D, LEU188C, LEU188D, LEU197C, LEU197D, LEU207C, LEU207D, LEU310C, LEU310D, LEU53D, LEU85C, LEU85D, LEU92C, LEU92D, LEU99C, LEU99D, LYS100C, LYS100D, LYS142C, LYS142D, LYS186C, LYS186D, LYS232C, LYS232D, LYS56D, MET203C, MET203D, MET209C, MET209D, PHE102C, PHE102D, PHE155C, PHE155D, PHE173C, PHE173D, PHE176C, PHE176D, PHE55C, PHE55D, PHE86C, PHE86D, PRO111C, PRO111D, PRO195C, PRO195D, PRO198C, PRO198D, PRO82C, PRO82D, PRO87C, PRO87D, SER141C, SER141D, SER175C, SER175D, SER278C, SER278D, SER2D, SER51C, SER51D, THR183C, THR183D, THR311C, THR311D, THR50C, THR50D, THR79C, THR79D, THR81C, THR81D, THR89C, THR89D, TRP312C, TRP312D, TYR104C, TYR104D, TYR115C, TYR115D, TYR189C, TYR189D, TYR208C, TYR208D, TYR49C, TYR49D, VAL124C, VAL124D, VAL132C, VAL132D, VAL177C, VAL177D, VAL193C, VAL193D, VAL75C, VAL75D, VAL77C, VAL77D, VAL93C, VAL93D