2ODO

crystal structure of pseudomonas fluorescens alanine racemase

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 265
  • Norm. En. per Res.: -3.8243
• 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	-100.1559	-139.0537	-761.349	-1000.5586	265	32	12	29344	6	102	79
B-D	-17.9927	20.4153	-63.3229	-60.9003	40	7	2	2889	0	12	11
C-D	-111.5889	-147.0079	-754.833	-1013.4298	265	26	12	29296	8	103	79

Interface residues

• A-B: ALA160A, ALA160B, ALA162A, ALA162B, ALA255A, ALA255B, ALA269A, ALA269B, ALA273A, ALA273B, ALA280A, ALA280B, ALA333A, ALA333B, ALA336A, ALA336B, ALA34A, ALA34B, ALA36A, ALA36B, ALA4A, ALA4B, ALA58A, ALA58B, ALA84A, ALA84B, ARG129A, ARG129B, ARG161A, ARG161B, ARG169A, ARG169B, ARG243A, ARG243B, ARG256A, ARG256B, ARG278A, ARG278B, ARG298A, ARG298B, ARG2A, ARG2B, ARG349A, ARG349B, ARG352A, ARG352B, ASN192A, ASN192B, ASN346A, ASN346B, ASP124A, ASP124B, ASP136A, ASP136B, ASP163A, ASP163B, ASP274A, ASP274B, ASP302A, ASP302B, ASP337A, ASP337B, ASP35A, ASP35B, ASP85A, ASP85B, CYS167A, CYS167B, CYS241A, CYS241B, CYS305A, CYS305B, CYS345A, CYS345B, CYS59A, CYS59B, GLN104A, GLN104B, GLN173A, GLN173B, GLN279A, GLN279B, GLN342A, GLN342B, GLU164A, GLU164B, GLU172A, GLU172B, GLU244A, GLU244B, GLU249A, GLU249B, GLU61A, GLU61B, GLU62A, GLU62B, GLU79A, GLU79B, GLU83A, GLU83B, GLU86A, GLU86B, GLY126A, GLY126B, GLY131A, GLY131B, GLY210A, GLY210B, GLY248A, GLY248B, GLY252A, GLY252B, GLY254A, GLY254B, GLY266A, GLY266B, GLY271A, GLY271B, GLY275A, GLY275B, GLY317A, GLY38A, GLY38B, GLY40A, GLY40B, GLY80A, GLY80B, HIS100A, HIS100B, HIS128A, HIS128B, HIS133A, HIS133B, HIS158A, HIS158B, HIS39A, HIS39B, ILE240A, ILE240B, ILE258A, ILE258B, ILE265A, ILE265B, ILE32A, ILE32B, ILE339A, ILE339B, ILE343A, ILE343B, ILE60A, ILE60B, LEU102A, LEU102B, LEU123A, LEU123B, LEU132A, LEU132B, LEU211A, LEU211B, LEU245A, LEU245B, LEU304A, LEU304B, LEU316A, LEU316B, LEU347A, LEU347B, LEU64A, LEU64B, LEU78A, LEU78B, LEU87A, LEU87B, LEU89A, LEU89B, LYS238A, LYS238B, LYS348A, LYS348B, MET127A, MET127B, MET1A, MET1B, MET233A, MET233B, MET270A, MET270B, MET301A, MET301B, MET303A, MET303B, PHE159A, PHE159B, PHE257A, PHE257B, PHE344A, PHE344B, PHE81A, PHE81B, PHE82A, PHE82B, PRO134A, PRO134B, PRO194A, PRO194B, PRO246A, PRO246B, PRO250A, PRO250B, PRO277A, PRO277B, PRO340A, PRO340B, PRO351A, PRO351B, PRO3A, PRO3B, SER101A, SER101B, SER125A, SER125B, SER237A, SER237B, SER300A, SER300B, THR259A, THR259B, THR334A, THR338A, THR338B, TRP103A, TRP103B, TYR214A, TYR214B, TYR253A, TYR253B, TYR272A, TYR272B, TYR276A, TYR276B, TYR341A, TYR341B, TYR37A, TYR37B, VAL130A, VAL130B, VAL239A, VAL239B, VAL242A, VAL242B, VAL251A, VAL251B, VAL267A, VAL267B, VAL268A, VAL268B, VAL299A, VAL299B, VAL31A, VAL31B, VAL350A, VAL350B, VAL57A, VAL57B, VAL98A
• B-D: ALA45B, ALA47B, ALA50B, ALA69B, ARG14B, ARG292D, ARG43B, ARG72B, ASN326D, ASP289D, ASP310D, ASP9B, GLN11B, GLN294D, GLN313D, GLN46B, GLU331D, GLU49B, GLU51B, GLY290D, GLY356B, GLY70B, ILE327D, ILE71B, ILE8B, LEU10B, LEU328D, LEU353B, LEU48B, PHE287D, PRO285D, PRO312D, SER293D, SER355B, THR309D, TYR354B, VAL288D, VAL291D, VAL311D, VAL42B
• C-D: ALA160C, ALA160D, ALA162C, ALA162D, ALA255C, ALA255D, ALA269C, ALA269D, ALA273C, ALA273D, ALA280C, ALA280D, ALA333C, ALA333D, ALA336C, ALA336D, ALA34C, ALA34D, ALA36C, ALA36D, ALA4C, ALA4D, ALA58C, ALA58D, ALA84C, ALA84D, ARG129C, ARG129D, ARG161C, ARG161D, ARG169C, ARG169D, ARG243C, ARG243D, ARG256C, ARG256D, ARG278C, ARG278D, ARG298C, ARG298D, ARG2C, ARG2D, ARG349C, ARG349D, ARG352C, ARG352D, ASN192C, ASN192D, ASN346C, ASN346D, ASP124C, ASP124D, ASP136C, ASP136D, ASP163C, ASP163D, ASP274C, ASP274D, ASP302C, ASP302D, ASP337C, ASP337D, ASP35C, ASP35D, ASP85C, ASP85D, CYS167C, CYS167D, CYS241C, CYS241D, CYS305C, CYS305D, CYS345C, CYS345D, CYS59C, CYS59D, GLN104C, GLN104D, GLN173D, GLN279C, GLN279D, GLN342C, GLN342D, GLU164C, GLU164D, GLU172C, GLU172D, GLU244C, GLU244D, GLU249C, GLU249D, GLU61C, GLU61D, GLU62C, GLU62D, GLU79C, GLU79D, GLU83C, GLU83D, GLU86C, GLU86D, GLY126C, GLY126D, GLY131C, GLY131D, GLY210C, GLY210D, GLY248C, GLY248D, GLY252C, GLY252D, GLY254C, GLY254D, GLY266C, GLY266D, GLY271C, GLY271D, GLY275C, GLY275D, GLY317C, GLY317D, GLY38C, GLY38D, GLY40C, GLY40D, GLY80C, GLY80D, HIS100C, HIS100D, HIS128C, HIS128D, HIS133C, HIS133D, HIS158C, HIS158D, HIS39C, HIS39D, ILE240C, ILE240D, ILE258C, ILE258D, ILE265C, ILE265D, ILE32C, ILE32D, ILE339C, ILE339D, ILE343C, ILE343D, ILE60C, ILE60D, LEU102C, LEU102D, LEU123C, LEU123D, LEU132C, LEU132D, LEU211C, LEU211D, LEU245C, LEU245D, LEU304C, LEU304D, LEU316C, LEU316D, LEU347C, LEU347D, LEU64C, LEU64D, LEU78C, LEU78D, LEU87C, LEU87D, LEU89C, LEU89D, LYS238C, LYS238D, LYS348C, LYS348D, MET127C, MET127D, MET1C, MET1D, MET233C, MET233D, MET270C, MET270D, MET301C, MET301D, MET303C, MET303D, PHE159C, PHE159D, PHE257C, PHE257D, PHE344C, PHE344D, PHE81C, PHE81D, PHE82C, PHE82D, PRO134C, PRO134D, PRO194C, PRO194D, PRO246C, PRO246D, PRO250C, PRO250D, PRO277C, PRO277D, PRO340C, PRO340D, PRO351C, PRO351D, PRO3C, PRO3D, SER101C, SER101D, SER125C, SER125D, SER237C, SER237D, SER300C, SER300D, THR259C, THR259D, THR334D, THR338C, THR338D, TRP103C, TRP103D, TYR214C, TYR214D, TYR253C, TYR253D, TYR272C, TYR272D, TYR276C, TYR276D, TYR341C, TYR341D, TYR37C, TYR37D, VAL130C, VAL130D, VAL239C, VAL239D, VAL242C, VAL242D, VAL251C, VAL251D, VAL267C, VAL267D, VAL268C, VAL268D, VAL299C, VAL299D, VAL31C, VAL31D, VAL350C, VAL350D, VAL57C, VAL57D, VAL98C