2F8J

crystal structure of histidinol-phosphate aminotransferase (ec 2.6.1.9) (imidazole acetol-phosphate transferase) (tm1040) from thermotoga maritima at 2.40 a resolution

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 290
  • Norm. En. per Res.: -3.8211
• Hub Node: A(3)

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	-158.8201	-27.1977	-922.111	-1108.1288	290	30	46	36140	0	66	65
A-C	-31.6752	-19.0254	-118.604	-169.3047	59	6	2	5131	0	35	27
A-D	0.0	0.0	-0.0539	-0.0539	5	0	0	27	0	10	6
B-D	0.0	0.0	-0.1116	-0.1116	5	0	0	30	0	8	12
C-D	-151.4882	-22.0518	-870.111	-1043.651	279	29	46	34799	0	59	64

Interface residues

• A-B: ALA115A, ALA115B, ALA118A, ALA11A, ALA11B, ALA168A, ALA168B, ALA175A, ALA175B, ALA195A, ALA195B, ALA207A, ALA207B, ALA208A, ALA208B, ALA216A, ALA216B, ALA223A, ALA223B, ALA25A, ALA25B, ALA49A, ALA49B, ALA85A, ALA85B, ALA8A, ALA8B, ARG10A, ARG10B, ARG19A, ARG19B, ARG210A, ARG210B, ARG226A, ARG226B, ARG228A, ARG228B, ARG254A, ARG254B, ARG308A, ARG308B, ARG315A, ARG315B, ARG43A, ARG43B, ARG51A, ARG51B, ARG98A, ARG98B, ASN149A, ASN193A, ASN193B, ASN225A, ASN225B, ASN232A, ASN232B, ASN27A, ASN27B, ASN282A, ASN282B, ASN29A, ASN29B, ASN2A, ASN2B, ASN46A, ASN46B, ASN83A, ASN83B, ASP140A, ASP140B, ASP222A, ASP222B, ASP36A, ASP36B, ASP39A, ASP39B, ASP48A, ASP48B, ASP55A, ASP55B, ASP58A, ASP58B, ASP5A, ASP5B, ASP86A, ASP86B, ASP97A, ASP97B, CYS108A, CYS108B, GLN209A, GLN209B, GLN238A, GLN238B, GLU138A, GLU138B, GLU15A, GLU15B, GLU17A, GLU17B, GLU192A, GLU192B, GLU218A, GLU218B, GLU28A, GLU28B, GLU323A, GLU323B, GLU35A, GLU35B, GLU40A, GLU40B, GLU59A, GLU59B, GLU87A, GLU87B, GLY117A, GLY117B, GLY137A, GLY137B, GLY139A, GLY139B, GLY167A, GLY167B, GLY319A, GLY319B, GLY82A, GLY82B, GLY84A, GLY84B, HIS0A, ILE111A, ILE111B, ILE221A, ILE221B, ILE318A, ILE318B, ILE52A, ILE52B, ILE62A, ILE7A, ILE7B, ILE88A, ILE88B, ILE89A, ILE89B, LEU194A, LEU194B, LEU206A, LEU206B, LEU229A, LEU229B, LEU24A, LEU24B, LEU26A, LEU26B, LEU37A, LEU37B, LEU45A, LEU45B, LEU4A, LEU4B, LEU50A, LEU50B, LEU6A, LEU6B, LEU94A, LEU94B, LYS114A, LYS114B, LYS18A, LYS18B, LYS202A, LYS202B, LYS219A, LYS219B, LYS21A, LYS21B, LYS320A, LYS320B, LYS9A, LYS9B, MET1A, MET239A, MET239B, MET92A, MET92B, MET95A, MET95B, PHE112A, PHE112B, PHE169A, PHE169B, PHE200A, PHE200B, PHE204A, PHE204B, PHE220A, PHE220B, PHE231A, PHE231B, PHE240A, PHE240B, PHE31A, PHE31B, PHE33A, PHE33B, PHE42A, PHE42B, PHE96A, PHE96B, PRO13A, PRO13B, PRO230A, PRO230B, PRO30A, PRO30B, PRO32A, PRO32B, PRO34A, PRO34B, PRO3A, PRO3B, PRO57A, PRO57B, SER201A, SER201B, SER205A, SER205B, SER217A, SER217B, SER234A, SER234B, SER237A, SER237B, SER47A, SER47B, SER56A, SER56B, SER80A, SER80B, THR16A, THR16B, THR199A, THR199B, THR22A, THR22B, THR317A, THR317B, TYR106A, TYR106B, TYR12A, TYR12B, TYR14A, TYR14B, TYR176A, TYR176B, TYR224A, TYR224B, TYR235A, TYR235B, TYR23A, TYR23B, TYR53A, TYR53B, TYR54A, TYR54B, TYR90A, TYR90B, VAL116A, VAL116B, VAL141A, VAL141B, VAL211A, VAL211B, VAL227A, VAL227B, VAL233A, VAL233B, VAL236A, VAL236B, VAL38A, VAL38B, VAL41A, VAL41B, VAL79A, VAL81A, VAL81B, VAL91A, VAL91B
• A-C: ALA113C, ALA118C, ALA216A, ARG10C, ARG110C, ARG98C, ASN135C, ASN193A, ASN77A, ASN78A, ASP140C, ASP186A, ASP222A, ASP70A, ASP72A, ASP97C, GLU122C, GLU133C, GLU138C, GLU192A, GLU218A, GLU63A, GLY137C, GLY139C, ILE62A, LEU121C, LEU188A, LEU194A, LEU66A, LEU69A, LEU74A, LYS114C, LYS119C, LYS165A, LYS189A, LYS190A, LYS219A, LYS76A, PHE101C, PHE102C, PHE120C, PHE187A, PHE220A, PHE73A, PHE96C, PRO124C, PRO132C, SER217A, SER67A, SER75A, SER99C, THR166C, THR71A, TYR191A, VAL100C, VAL123C, VAL134C, VAL136C, VAL79A
• A-D: ASN2D, ASN77A, LEU6D, LYS76A, PRO3D
• B-D: ARG110D, ASN304B, GLU15B, LEU6D, THR16B
• C-D: ALA115C, ALA115D, ALA11C, ALA11D, ALA168C, ALA168D, ALA175C, ALA175D, ALA195C, ALA207C, ALA207D, ALA208C, ALA208D, ALA216C, ALA223C, ALA223D, ALA25C, ALA25D, ALA49C, ALA49D, ALA85C, ALA85D, ALA8C, ALA8D, ARG10C, ARG10D, ARG19C, ARG19D, ARG210C, ARG210D, ARG226C, ARG226D, ARG228C, ARG228D, ARG254C, ARG254D, ARG308C, ARG308D, ARG315D, ARG43C, ARG43D, ARG51C, ARG51D, ARG98C, ARG98D, ASN193C, ASN225C, ASN225D, ASN232C, ASN232D, ASN27C, ASN27D, ASN282C, ASN282D, ASN29C, ASN29D, ASN2C, ASN2D, ASN46C, ASN46D, ASN83C, ASN83D, ASP140C, ASP140D, ASP20C, ASP222C, ASP222D, ASP36C, ASP36D, ASP39C, ASP39D, ASP48C, ASP48D, ASP55C, ASP55D, ASP58C, ASP58D, ASP5C, ASP5D, ASP86C, ASP86D, ASP97C, ASP97D, CYS108C, CYS108D, GLN209C, GLN209D, GLN238C, GLN238D, GLU138C, GLU138D, GLU15C, GLU15D, GLU17C, GLU17D, GLU192C, GLU218C, GLU218D, GLU28C, GLU28D, GLU323C, GLU323D, GLU35C, GLU35D, GLU40C, GLU40D, GLU59C, GLU59D, GLU87C, GLU87D, GLY117C, GLY117D, GLY137C, GLY137D, GLY139C, GLY139D, GLY167C, GLY167D, GLY319C, GLY319D, GLY82C, GLY82D, GLY84C, GLY84D, ILE111C, ILE111D, ILE221C, ILE221D, ILE318C, ILE318D, ILE52C, ILE52D, ILE7C, ILE7D, ILE88C, ILE88D, ILE89C, ILE89D, LEU194C, LEU206C, LEU206D, LEU229C, LEU229D, LEU24C, LEU24D, LEU26C, LEU26D, LEU37C, LEU37D, LEU45C, LEU45D, LEU4C, LEU4D, LEU50C, LEU50D, LEU6C, LEU6D, LEU94C, LEU94D, LYS114C, LYS114D, LYS18C, LYS18D, LYS202C, LYS202D, LYS219C, LYS219D, LYS21C, LYS21D, LYS320C, LYS320D, LYS9C, LYS9D, MET1C, MET239C, MET239D, MET92C, MET95C, MET95D, PHE112C, PHE112D, PHE169C, PHE169D, PHE200C, PHE200D, PHE204C, PHE204D, PHE220C, PHE220D, PHE231C, PHE231D, PHE240C, PHE240D, PHE31C, PHE31D, PHE33C, PHE33D, PHE42C, PHE42D, PHE96C, PHE96D, PRO13C, PRO13D, PRO230C, PRO230D, PRO30C, PRO30D, PRO32C, PRO32D, PRO34C, PRO34D, PRO3C, PRO3D, PRO57C, PRO57D, SER201C, SER201D, SER205C, SER205D, SER217C, SER217D, SER234C, SER234D, SER237C, SER237D, SER47C, SER47D, SER56C, SER56D, SER80C, SER80D, THR16C, THR16D, THR199C, THR199D, THR22C, THR22D, THR317C, THR317D, TYR106C, TYR106D, TYR12C, TYR12D, TYR14C, TYR14D, TYR176C, TYR176D, TYR224C, TYR224D, TYR235C, TYR235D, TYR23C, TYR23D, TYR53C, TYR53D, TYR54C, TYR54D, TYR90C, TYR90D, VAL116C, VAL116D, VAL141C, VAL141D, VAL211C, VAL211D, VAL227C, VAL227D, VAL233C, VAL233D, VAL236C, VAL236D, VAL38C, VAL38D, VAL41C, VAL41D, VAL81C, VAL81D, VAL91C, VAL91D