3DAP

c. glutamicum dap dehydrogenase in complex with nadp+ and the inhibitor 5s-isoxazoline

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 230
  • Norm. En. per Res.: -4.269
• 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	-171.9184	-75.9761	-733.966	-981.8605	230	19	33	31461	1	77	68

Interface residues

• A-B: ALA131A, ALA131B, ALA132A, ALA132B, ALA133A, ALA133B, ALA136A, ALA136B, ALA23B, ALA275A, ALA275B, ALA280A, ALA280B, ALA284A, ALA296A, ALA296B, ALA303A, ALA303B, ALA317A, ALA317B, ARG128A, ARG128B, ARG180A, ARG180B, ARG181A, ARG269A, ARG269B, ARG283A, ARG283B, ARG287A, ARG287B, ARG318A, ARG318B, ARG93A, ARG93B, ARG97A, ARG97B, ARG99A, ARG99B, ASN127A, ASN127B, ASN258A, ASN258B, ASN270A, ASN270B, ASN311A, ASN91A, ASN91B, ASP120A, ASP120B, ASP253A, ASP253B, ASP268A, ASP268B, ASP272A, ASP272B, ASP313A, ASP313B, ASP314A, ASP314B, ASP319A, ASP319B, ASP90A, ASP90B, ASP94A, ASP94B, GLN100A, GLN100B, GLN140A, GLN140B, GLN25A, GLN25B, GLN278A, GLN278B, GLN293B, GLU137A, GLU137B, GLU177A, GLU262A, GLU262B, GLU301A, GLU301B, GLU310A, GLU310B, GLY118A, GLY118B, GLY122A, GLY122B, GLY241A, GLY241B, GLY245A, GLY245B, GLY246A, GLY246B, GLY252A, GLY252B, GLY255A, GLY255B, GLY256A, GLY256B, HIS138A, HIS138B, HIS244A, HIS244B, HIS247A, HIS247B, HIS259A, HIS259B, HIS92A, HIS92B, ILE126A, ILE126B, ILE22B, ILE249A, ILE249B, ILE264A, ILE264B, ILE279A, ILE279B, ILE316A, ILE316B, ILE95A, ILE95B, LEU135A, LEU135B, LEU21A, LEU21B, LEU265A, LEU265B, LEU267A, LEU267B, LEU300A, LEU300B, LEU306A, LEU306B, LEU307A, LEU307B, LEU312A, LEU312B, LEU315A, LEU315B, LYS20A, LYS20B, LYS24A, LYS24B, LYS266A, LYS266B, MET123A, MET123B, MET242A, MET242B, MET288A, PHE124A, PHE124B, PHE257A, PHE257B, PHE273A, PHE273B, PHE281A, PHE281B, PHE297A, PHE297B, PRO121A, PRO121B, PRO243A, PRO243B, PRO26A, PRO26B, PRO271A, PRO271B, PRO304A, PRO304B, PRO309A, PRO309B, PRO96A, PRO96B, SER116A, SER116B, SER125A, SER125B, SER17A, SER17B, SER276A, SER276B, SER277A, SER277B, SER308A, SER308B, THR117A, THR117B, THR142A, THR240A, THR250A, THR250B, THR251A, THR251B, THR254A, THR254B, THR260A, THR260B, THR274A, THR274B, THR298A, THR298B, TRP119A, TRP119B, TYR130A, TYR130B, TYR263A, TYR263B, TYR305A, TYR305B, TYR89A, TYR89B, VAL115A, VAL115B, VAL129A, VAL129B, VAL134A, VAL134B, VAL248A, VAL248B, VAL261A, VAL261B, VAL299A, VAL299B, VAL302A, VAL302B, VAL320A, VAL320B