3AL0

crystal structure of the glutamine transamidosome from thermotoga maritima in the glutamylation state.

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 176
  • Norm. En. per Res.: -3.6638
• 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	-43.8155	-9.4207	-347.466	-400.7023	138	23	8	15173	1	18	28
A-C	-36.2094	-58.975	-634.155	-729.3394	218	60	24	28475	3	90	57
B-C	-114.6021	-30.4862	-499.747	-644.8352	176	40	10	20879	2	58	51

Interface residues

• A-B: ALA141B, ALA192A, ALA194A, ALA225A, ALA301A, ALA303A, ALA308A, ALA353A, ALA354A, ALA48B, ALA92A, ARG187A, ARG275B, ARG309A, ARG318A, ARG325A, ARG332A, ARG367A, ARG368A, ARG76B, ARG79B, ASN223A, ASN306A, ASN361A, ASN68A, ASN81B, ASP198A, ASP221A, ASP224A, ASP273B, ASP281B, ASP311A, ASP86B, CYS23B, CYS39B, CYS42B, CYS78A, GLN45B, GLN92B, GLU222A, GLU269B, GLU270B, GLU279B, GLU302A, GLU357A, GLU87A, GLY189A, GLY316A, GLY323A, GLY347A, GLY44B, GLY47B, GLY90B, HIS133B, ILE282B, ILE298A, ILE344A, ILE69A, ILE93B, LEU131B, LEU190A, LEU197A, LEU307A, LEU324A, LEU351A, LEU49B, LEU70A, LEU83A, LEU87B, LYS268B, LYS314A, LYS322A, LYS80B, LYS89B, MET148B, MET327A, MET364A, PHE114A, PHE22B, PHE277B, PHE310A, PHE336A, PHE349A, PHE360A, PHE83B, PHE90A, PHE97B, PRO278B, PRO280B, PRO283B, PRO284B, PRO40B, PRO46B, PRO50B, PRO52B, PRO85B, PRO88B, SER142B, SER144B, SER186A, SER195A, SER196A, SER24B, SER272B, SER304A, SER305A, SER352A, SER88A, THR226A, THR227A, THR348A, THR350A, THR43B, THR76A, THR77A, THR93A, TYR143B, TYR182A, TYR188A, TYR274B, TYR276B, TYR315A, TYR328A, TYR355A, TYR356A, TYR74B, TYR82B, TYR84B, TYR86A, TYR91B, TYR96B, VAL146B, VAL191A, VAL228A, VAL313A, VAL41B, VAL51B, VAL89A
• A-C: ALA16C, ALA225A, ALA293A, ALA303A, ALA308A, ALA353A, ALA354A, ALA358A, ALA363A, ALA415A, ALA418A, ALA61C, ARG122A, ARG17C, ARG187A, ARG220A, ARG230A, ARG318A, ARG325A, ARG332A, ARG341A, ARG342A, ARG343A, ARG367A, ARG368A, ARG443A, ARG64C, ARG69C, ARG74C, ARG75A, ARG81A, ASN14C, ASN223A, ASN229A, ASN333A, ASN361A, ASN375A, ASN416A, ASN43C, ASN80C, ASN85A, ASP198A, ASP224A, ASP23C, ASP311A, ASP31C, ASP372A, ASP37C, ASP401A, ASP46C, ASP59C, ASP75C, ASP91A, GLN199A, GLN24C, GLN33C, GLU13C, GLU19C, GLU222A, GLU252A, GLU302A, GLU321A, GLU326A, GLU338A, GLU339A, GLU34C, GLU357A, GLU40C, GLU44C, GLU48C, GLU51C, GLU58C, GLU72C, GLU83C, GLU84A, GLU84C, GLU87A, GLY183A, GLY312A, GLY316A, GLY323A, GLY335A, GLY337A, GLY347A, GLY419A, GLY49C, GLY66C, GLY73A, GLY93C, HIS11C, HIS256A, HIS287A, ILE298A, ILE319A, ILE344A, ILE346A, ILE35C, ILE370A, ILE399A, ILE410A, ILE77C, ILE82A, ILE89C, ILE94C, LEU10C, LEU12C, LEU15C, LEU184A, LEU18C, LEU197A, LEU20C, LEU28C, LEU307A, LEU317A, LEU324A, LEU351A, LEU36C, LEU403A, LEU407A, LEU417A, LEU41C, LEU420A, LEU42C, LEU63C, LEU70A, LEU72A, LEU76C, LEU83A, LEU8C, LYS289A, LYS30C, LYS314A, LYS320A, LYS322A, LYS330A, LYS362A, LYS365A, LYS369A, LYS3C, LYS400A, LYS62C, LYS78C, LYS79C, LYS90C, LYS96A, MET29C, MET327A, MET329A, MET345A, MET364A, MET53C, MET73C, PHE32C, PHE336A, PHE349A, PHE360A, PHE444A, PHE71C, PHE81C, PHE90A, PRO300A, PRO402A, PRO52C, PRO56C, PRO82C, PRO92C, SER195A, SER196A, SER21C, SER27C, SER291A, SER304A, SER305A, SER352A, SER371A, SER60C, SER88A, THR181A, THR226A, THR227A, THR294A, THR331A, THR348A, THR350A, THR404A, THR55C, THR5C, TYR182A, TYR188A, TYR290A, TYR295A, TYR296A, TYR315A, TYR328A, TYR355A, TYR356A, TYR359A, TYR38C, TYR405A, TYR406A, TYR54C, TYR86A, VAL228A, VAL292A, VAL297A, VAL313A, VAL334A, VAL340A, VAL366A, VAL39C, VAL45C, VAL47C, VAL4C, VAL50C, VAL57C, VAL89A, VAL91C, VAL9C
• B-C: ALA141B, ALA16C, ALA21B, ALA258B, ALA27B, ALA37B, ALA61C, ARG140B, ARG17C, ARG225B, ARG275B, ARG58B, ARG64C, ARG69C, ARG74C, ARG76B, ARG79B, ASN149B, ASN14C, ASN222B, ASN285C, ASN35B, ASN363B, ASN53B, ASN80C, ASN81B, ASP136B, ASP147B, ASP190B, ASP273B, ASP281B, ASP284C, ASP28B, ASP59C, ASP67C, ASP75C, ASP78B, ASP86B, ASP86C, CYS151B, CYS23B, CYS25B, CYS39B, CYS42B, GLN45B, GLU134B, GLU192B, GLU242C, GLU269B, GLU270B, GLU271B, GLU279B, GLU282C, GLU289C, GLU31B, GLU51C, GLU54B, GLU55B, GLU58C, GLU72C, GLU83C, GLU84C, GLY135B, GLY267B, GLY269C, GLY44B, GLY66C, GLY87C, GLY93C, HIS11C, HIS133B, HIS88C, ILE282B, ILE38B, ILE57B, ILE77C, ILE89C, ILE94C, LEU12C, LEU131B, LEU145B, LEU15C, LEU18C, LEU243C, LEU267C, LEU287B, LEU32B, LEU49B, LEU63C, LEU76C, LYS130B, LYS18B, LYS193B, LYS20B, LYS265C, LYS268B, LYS270C, LYS62C, LYS65C, LYS78C, LYS85C, LYS90C, MET148B, MET257B, MET53C, MET56B, MET73C, PHE226B, PHE22B, PHE244C, PHE277B, PHE30B, PHE70C, PHE71C, PHE77B, PHE81C, PHE83B, PRO268C, PRO26B, PRO278B, PRO280B, PRO283B, PRO284B, PRO33B, PRO34B, PRO40B, PRO46B, PRO50B, PRO52B, PRO52C, PRO56C, PRO68C, PRO85B, PRO88B, PRO92C, SER137B, SER142B, SER144B, SER223B, SER240C, SER24B, SER272B, SER286C, SER288B, SER60C, SER75B, THR139B, THR17B, THR19B, THR245C, THR246C, THR259B, THR287C, THR36B, THR43B, THR55C, TYR143B, TYR247C, TYR253C, TYR274B, TYR280C, TYR291B, TYR54C, TYR74B, TYR82B, TYR84B, TYR98B, VAL132B, VAL146B, VAL285B, VAL286B, VAL29B, VAL41B, VAL51B, VAL57C, VAL91C