2IZZ

crystal structure of human pyrroline-5-carboxylate reductase

• Total interactions analyzed: 10
• Total true interactions: 8
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 274
  • Norm. En. per Res.: -5.5183
• Hub Node: A(4)

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	-78.7597	-128.6474	-1304.62	-1512.0271	274	30	87	55396	7	50	43
A-C	-20.5007	20.9496	-97.3025	-96.8536	48	3	1	3559	2	19	15
A-D	0.0	12.2523	-0.8365	11.4158	32	0	0	296	0	10	9
A-E	-12.3543	4.1982	-96.5572	-104.7132	46	3	1	3660	3	19	14
B-C	-26.7929	-32.6868	-152.96	-212.4396	70	5	0	5214	4	16	17
B-D	-13.6358	25.7996	-96.181	-84.0172	48	3	1	3657	1	20	16
B-E	0.0	12.6339	-0.5535	12.0804	24	0	0	194	0	9	7
C-D	-82.4849	-132.5536	-1287.9	-1502.9385	274	29	89	54917	6	52	44

Interface residues

• A-B: ALA132A, ALA132B, ALA14A, ALA14B, ALA169A, ALA169B, ALA179A, ALA179B, ALA181A, ALA181B, ALA184A, ALA184B, ALA187A, ALA187B, ALA189A, ALA189B, ALA202A, ALA202B, ALA207A, ALA207B, ALA209A, ALA209B, ALA213A, ALA213B, ALA214A, ALA214B, ALA237A, ALA237B, ALA241A, ALA241B, ALA257A, ALA257B, ALA260A, ALA260B, ALA40A, ALA40B, ALA97A, ALA97B, ARG129A, ARG129B, ARG199A, ARG199B, ARG200A, ARG200B, ARG204A, ARG204B, ARG251A, ARG251B, ARG264A, ARG264B, ARG266A, ARG266B, ASN123A, ASN123B, ASN230A, ASN230B, ASN256A, ASN256B, ASP165A, ASP165B, ASP168A, ASP168B, ASP186A, ASP186B, ASP190A, ASP190B, ASP229A, ASP229B, CYS159A, CYS159B, CYS262A, CYS262B, GLN10A, GLN10B, GLN208A, GLN208B, GLN222A, GLN222B, GLN226A, GLN226B, GLU130A, GLU130B, GLU161A, GLU161B, GLU163A, GLU163B, GLU221A, GLU246A, GLU246B, GLU259A, GLU259B, GLU267A, GLU267B, GLY131A, GLY131B, GLY157A, GLY157B, GLY172A, GLY172B, GLY175A, GLY175B, GLY177A, GLY177B, GLY191A, GLY191B, GLY192A, GLY192B, GLY196A, GLY196B, GLY206A, GLY206B, GLY212A, GLY212B, GLY225A, GLY225B, GLY235A, GLY235B, GLY236A, GLY236B, GLY248A, GLY248B, GLY249A, GLY249B, GLY98A, GLY98B, HIS219A, HIS219B, HIS223A, HIS223B, HIS240A, HIS240B, HIS243A, HIS243B, HIS73A, HIS73B, ILE167A, ILE167B, ILE239A, ILE239B, ILE255A, ILE255B, ILE263A, ILE263B, LEU11A, LEU11B, LEU166A, LEU166B, LEU173A, LEU173B, LEU185A, LEU185B, LEU188A, LEU188B, LEU197A, LEU197B, LEU201A, LEU201B, LEU205A, LEU205B, LEU210A, LEU210B, LEU211A, LEU211B, LEU217A, LEU217B, LEU218A, LEU218B, LEU227A, LEU227B, LEU242A, LEU242B, LEU245A, LEU245B, LEU253A, LEU253B, LEU254A, LEU254B, LEU268A, LEU268B, LYS17A, LYS194A, LYS194B, LYS215A, LYS215B, LYS228A, LYS228B, LYS71A, LYS71B, MET121A, MET121B, MET195A, MET195B, MET216A, MET216B, PHE13A, PHE13B, PHE158A, PHE158B, PHE182A, PHE182B, PHE250A, PHE250B, PRO125A, PRO125B, PRO178A, PRO178B, PRO198A, PRO198B, PRO224A, PRO224B, PRO234A, PRO234B, PRO72A, PRO72B, SER174A, SER174B, SER176A, SER176B, SER220A, SER220B, SER232A, SER232B, SER233A, SER233B, SER247A, SER247B, SER252A, SER252B, SER261A, SER261B, THR122A, THR122B, THR124A, THR124B, THR133A, THR133B, THR160A, THR160B, THR171A, THR171B, THR183A, THR183B, THR238A, THR238B, THR265A, THR265B, THR41A, THR41B, TYR180A, TYR180B, VAL126A, VAL126B, VAL127A, VAL127B, VAL128A, VAL128B, VAL134A, VAL134B, VAL156A, VAL156B, VAL162A, VAL162B, VAL170A, VAL170B, VAL193A, VAL193B, VAL203A, VAL203B, VAL231A, VAL231B, VAL244A, VAL244B, VAL258A, VAL258B
• A-C: ALA187A, ALA189A, ALA202A, ALA237C, ALA241C, ARG199A, ARG200A, ARG251C, ARG264A, ARG266C, ASN230C, ASP165C, ASP186A, ASP190A, ASP229C, GLN226C, GLU163C, GLU246C, GLY191A, GLY192A, GLY196A, GLY225C, GLY235C, GLY236C, HIS223C, HIS240C, HIS243C, HIS73A, ILE239C, ILE74A, LEU166C, LEU197A, LEU242C, LYS194A, LYS228C, MET195A, PRO198A, PRO234C, SER232C, SER233C, SER247C, THR183A, THR238C, VAL193A, VAL203A, VAL231C, VAL244A, VAL244C
• A-D: ALA260A, ALA260D, ALA40A, ALA40D, ARG199A, ARG199D, ARG200A, ARG200D, ARG264A, ARG264D, ASP186A, ASP186D, ASP190D, ASP38A, ASP38D, GLN10A, GLN10D, GLY196A, GLY196D, HIS73D, LEU39A, LEU39D, LYS194A, LYS194D, LYS71A, MET195A, MET195D, PRO198A, PRO198D, THR183A, THR41D, VAL193D
• A-E: ALA187E, ALA189E, ALA202E, ALA237A, ALA241A, ARG199E, ARG200E, ARG251A, ARG264E, ARG266A, ASN230A, ASP165A, ASP186E, ASP190E, ASP229A, GLN226A, GLU246A, GLY191E, GLY192E, GLY196E, GLY225A, GLY235A, GLY236A, HIS223A, HIS240A, HIS243A, HIS73E, ILE239A, LEU197E, LEU201E, LEU242A, LYS194E, LYS228A, MET195E, PRO198E, PRO234A, SER232A, SER233A, SER247A, THR183E, THR238A, VAL193E, VAL203E, VAL231A, VAL244A, VAL244E
• B-C: ALA257B, ALA257C, ALA260B, ALA260C, ARG251B, ARG251C, ARG266B, ARG266C, ASN230B, ASN230C, ASN256B, ASN256C, ASP229B, ASP229C, GLN222B, GLN222C, GLN226B, GLN226C, GLU221B, GLU221C, GLU246B, GLU246C, GLU259B, GLU259C, GLY225B, GLY225C, GLY235B, GLY235C, GLY248B, GLY248C, GLY249B, GLY249C, HIS223B, HIS223C, HIS240B, HIS240C, HIS243B, HIS243C, ILE239B, ILE239C, ILE255B, ILE255C, ILE263B, ILE263C, LEU166B, LEU166C, LEU227B, LEU227C, LEU242B, LEU242C, LEU245B, LEU245C, LEU253B, LEU253C, LEU254B, LEU254C, LYS228B, LYS228C, PHE250B, PHE250C, PRO224B, PRO224C, PRO234B, PRO234C, SER247B, SER247C, SER252B, SER252C, VAL244B, VAL244C
• B-D: ALA187D, ALA189D, ALA202D, ALA237B, ALA241B, ARG199D, ARG200D, ARG251B, ARG264D, ARG266B, ASN230B, ASP165B, ASP186D, ASP190D, ASP229B, GLN226B, GLU163B, GLU246B, GLY191D, GLY192D, GLY196D, GLY225B, GLY235B, GLY236B, HIS223B, HIS240B, HIS243B, HIS73D, ILE239B, ILE74D, LEU166B, LEU197D, LEU242B, LYS194D, LYS228B, MET195D, PRO198D, PRO234B, SER232B, SER233B, SER247B, THR183D, THR238B, VAL193D, VAL203D, VAL231B, VAL244B, VAL244D
• B-E: ALA260B, ALA260E, ALA40B, ALA40E, ARG200B, ARG200E, ARG264B, ARG264E, ASP186B, ASP186E, ASP190B, GLY196B, GLY196E, LEU39B, LEU39E, LYS194B, LYS194E, LYS71B, LYS71E, MET195B, MET195E, PRO198B, PRO198E, THR183E
• C-D: ALA132C, ALA132D, ALA14C, ALA14D, ALA169C, ALA169D, ALA179C, ALA179D, ALA181C, ALA181D, ALA184C, ALA184D, ALA187C, ALA187D, ALA189C, ALA189D, ALA202C, ALA202D, ALA207C, ALA207D, ALA209C, ALA209D, ALA213C, ALA213D, ALA214C, ALA214D, ALA237C, ALA237D, ALA241C, ALA241D, ALA257C, ALA257D, ALA260C, ALA260D, ALA40C, ALA40D, ALA97C, ALA97D, ARG129C, ARG129D, ARG199C, ARG199D, ARG200C, ARG200D, ARG204C, ARG204D, ARG251C, ARG251D, ARG264C, ARG264D, ARG266C, ARG266D, ASN123C, ASN123D, ASN230C, ASN230D, ASN256C, ASN256D, ASP165C, ASP165D, ASP168C, ASP168D, ASP186C, ASP186D, ASP190C, ASP190D, ASP229C, ASP229D, CYS159C, CYS159D, CYS262C, CYS262D, GLN10C, GLN10D, GLN208C, GLN208D, GLN222C, GLN222D, GLN226C, GLN226D, GLU130C, GLU130D, GLU161C, GLU161D, GLU163C, GLU163D, GLU246C, GLU246D, GLU259C, GLU259D, GLU267C, GLU267D, GLY131C, GLY131D, GLY157C, GLY157D, GLY172C, GLY172D, GLY175C, GLY175D, GLY177C, GLY177D, GLY191C, GLY191D, GLY192C, GLY192D, GLY196C, GLY196D, GLY206C, GLY206D, GLY212C, GLY212D, GLY225C, GLY225D, GLY235C, GLY235D, GLY236C, GLY236D, GLY248C, GLY248D, GLY249C, GLY249D, GLY98C, GLY98D, HIS219C, HIS219D, HIS223C, HIS223D, HIS240C, HIS240D, HIS243C, HIS243D, HIS73C, HIS73D, ILE167C, ILE167D, ILE239C, ILE239D, ILE255C, ILE255D, ILE263C, ILE263D, LEU11C, LEU11D, LEU166C, LEU166D, LEU173C, LEU173D, LEU185C, LEU185D, LEU188C, LEU188D, LEU197C, LEU197D, LEU201C, LEU201D, LEU205C, LEU205D, LEU210C, LEU210D, LEU211C, LEU211D, LEU217C, LEU217D, LEU218C, LEU218D, LEU227C, LEU227D, LEU242C, LEU242D, LEU245C, LEU245D, LEU253C, LEU253D, LEU254C, LEU254D, LEU268C, LEU268D, LYS17D, LYS194C, LYS194D, LYS215C, LYS215D, LYS228C, LYS228D, LYS71C, LYS71D, MET121C, MET121D, MET195C, MET195D, MET216C, MET216D, PHE13C, PHE13D, PHE158C, PHE158D, PHE182C, PHE182D, PHE250C, PHE250D, PRO125C, PRO125D, PRO178C, PRO178D, PRO198C, PRO198D, PRO224C, PRO224D, PRO234C, PRO234D, PRO72C, PRO72D, SER174C, SER174D, SER176C, SER176D, SER220C, SER220D, SER232C, SER232D, SER233C, SER233D, SER247C, SER247D, SER252C, SER252D, SER261C, SER261D, THR122C, THR122D, THR124C, THR124D, THR133C, THR133D, THR160C, THR160D, THR171C, THR171D, THR183C, THR183D, THR238C, THR238D, THR265C, THR265D, THR41C, THR41D, TYR180C, TYR180D, VAL126C, VAL126D, VAL127C, VAL127D, VAL128C, VAL128D, VAL134C, VAL134D, VAL156C, VAL156D, VAL162C, VAL162D, VAL170C, VAL170D, VAL193C, VAL193D, VAL203C, VAL203D, VAL231C, VAL231D, VAL244C, VAL244D, VAL258C, VAL258D, VAL70D