3UK1

crystal structure of a transketolase from burkholderia thailandensis with an oxidized cysteinesulfonic acid in the active site

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 376
  • Norm. En. per Res.: -4.0803
• 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	-229.5935	33.9363	-1338.53	-1534.1872	376	54	15	47984	12	162	157

Interface residues

• A-B: ALA186A, ALA186B, ALA190A, ALA190B, ALA227A, ALA227B, ALA282B, ALA399A, ALA399B, ALA414A, ALA414B, ALA417A, ALA417B, ALA42A, ALA42B, ALA441A, ALA469A, ALA469B, ALA473A, ALA473B, ALA474A, ALA474B, ALA505A, ALA505B, ALA665A, ALA665B, ARG111A, ARG111B, ARG224A, ARG224B, ARG416A, ARG416B, ARG435A, ARG435B, ARG467A, ARG467B, ARG471A, ARG471B, ARG508A, ARG508B, ARG544A, ARG544B, ARG633A, ARG633B, ARG634A, ARG634B, ARG646A, ARG646B, ASN109A, ASN109B, ASN215A, ASN215B, ASN405A, ASN405B, ASN431A, ASN431B, ASN43A, ASN43B, ASN468A, ASN468B, ASN512A, ASN512B, ASP175A, ASP175B, ASP210A, ASP210B, ASP212A, ASP212B, ASP219A, ASP219B, ASP220A, ASP220B, ASP400A, ASP400B, ASP464A, ASP464B, ASP494A, ASP494B, ASP614A, ASP614B, ASP617A, ASP617B, ASP643A, ASP643B, ASP659A, ASP659B, CYS187A, CYS187B, GLN112A, GLN112B, GLN138A, GLN138B, GLN499A, GLN499B, GLU122A, GLU122B, GLU180A, GLU180B, GLU185A, GLU185B, GLU226A, GLU226B, GLU436A, GLU436B, GLU493A, GLU493B, GLU502A, GLU502B, GLU652A, GLU652B, GLU663A, GLU663B, GLY119A, GLY119B, GLY134A, GLY134B, GLY137A, GLY137B, GLY139A, GLY139B, GLY174A, GLY174B, GLY176A, GLY176B, GLY181A, GLY181B, GLY191A, GLY191B, GLY211A, GLY211B, GLY229A, GLY229B, GLY281B, GLY397A, GLY397B, GLY403A, GLY403B, GLY433A, GLY433B, GLY438A, GLY438B, GLY45A, GLY45B, GLY492A, GLY492B, GLY495A, GLY495B, GLY631A, GLY631B, GLY650A, GLY650B, GLY653A, GLY653B, GLY662A, GLY662B, GLY85A, GLY85B, HIS114A, HIS114B, HIS120A, HIS120B, HIS184A, HIS184B, HIS218A, HIS218B, HIS280B, HIS429A, HIS429B, HIS46A, HIS46B, HIS498A, HIS498B, HIS503A, HIS503B, HIS630A, HIS630B, HIS673A, HIS673B, HIS86A, HIS86B, ILE125A, ILE125B, ILE182A, ILE182B, ILE207A, ILE207B, ILE209A, ILE209B, ILE430A, ILE430B, ILE489A, ILE489B, ILE510A, ILE510B, ILE582A, ILE582B, ILE658A, ILE658B, LEU113A, LEU113B, LEU136A, LEU136B, LEU178A, LEU178B, LEU189A, LEU189B, LEU193A, LEU193B, LEU401A, LEU401B, LEU460A, LEU460B, LEU470A, LEU470B, LEU475A, LEU475B, LEU491A, LEU491B, LEU507A, LEU507B, LEU509A, LEU509B, LEU513A, LEU513B, LEU628A, LEU628B, LEU651A, LEU651B, LEU670A, LEU670B, LYS194A, LYS194B, LYS223A, LYS223B, LYS256A, LYS256B, LYS477A, LYS477B, LYS647A, LYS647B, LYS672A, LYS672B, MET179A, MET179B, MET476A, MET476B, PHE110A, PHE110B, PHE217A, PHE217B, PHE225A, PHE225B, PHE437A, PHE437B, PHE459A, PHE459B, PHE462A, PHE462B, PHE644A, PHE644B, PHE661A, PHE661B, PHE674A, PHE674B, PRO118A, PRO118B, PRO121A, PRO121B, PRO135A, PRO135B, PRO222A, PRO222B, PRO283B, PRO496A, PRO496B, PRO511A, PRO511B, PRO537A, PRO537B, PRO629A, PRO629B, PRO666A, PRO666B, SER115A, SER115B, SER183A, SER183B, SER188A, SER188B, SER208A, SER208B, SER398A, SER398B, SER404A, SER404B, SER44A, SER44B, SER463A, SER463B, SER466A, SER466B, SER488A, SER488B, SER500A, SER500B, SER506A, SER506B, SER613A, SER613B, SER664A, SER664B, THR117A, THR117B, THR132A, THR132B, THR133A, THR133B, THR192A, THR192B, THR221A, THR221B, THR402A, THR402B, THR407A, THR407B, THR458A, THR461A, THR461B, THR497A, THR497B, THR642A, THR642B, THR660A, THR660B, TRP216A, TRP216B, TRP230A, TRP230B, TRP645A, TRP645B, TYR123A, TYR123B, TYR228A, TYR228B, TYR432A, TYR432B, TYR465A, TYR465B, TYR648A, TYR648B, TYR92A, TYR92B, VAL213A, VAL213B, VAL214A, VAL214B, VAL232A, VAL232B, VAL415A, VAL415B, VAL434A, VAL434B, VAL472A, VAL472B, VAL501A, VAL501B, VAL504A, VAL504B, VAL632A, VAL632B, VAL641A, VAL641B, VAL649A, VAL649B, VAL669A, VAL669B