2DF5

crystal structure of pf-pcp(1-204)-c

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 75
  • Norm. En. per Res.: -4.9026
• 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	-38.0795	-180.9517	-148.664	-367.6951	75	12	6	6445	13	28	9
A-C	-7.1557	1.849	-174.29	-179.5967	80	6	8	8388	0	13	21
A-D	0.0	0.0	-1.1127	-1.1127	20	0	0	267	0	2	8
B-C	-4.5462	5.6122	-26.2035	-25.1376	23	2	0	1147	0	3	9
B-D	-11.0372	2.6105	-195.055	-203.4817	82	19	9	9012	0	14	21
C-D	-29.599	-145.8069	-139.156	-314.5619	72	11	6	6327	12	27	10

Interface residues

• A-B: ALA107A, ALA107B, ALA110A, ALA110B, ALA137A, ALA137B, ALA82A, ALA82B, ALA85A, ALA85B, ALA88A, ALA88B, ARG80A, ARG80B, ARG89A, ARG89B, ASN135A, ASN135B, ASN143A, ASN143B, ASN84A, ASN84B, ASP100A, ASP100B, ASP87A, ASP87B, GLU101A, GLU101B, GLU99A, GLU99B, GLY138A, GLY138B, ILE103A, ILE103B, ILE117A, ILE117B, ILE133A, ILE133B, ILE81A, ILE81B, ILE86A, ILE86B, ILE98A, LEU139A, LEU139B, LEU150A, LEU150B, LYS118A, LYS118B, LYS97A, MET121A, MET121B, PHE112A, PHE112B, PRO102A, PRO102B, PRO108A, PRO108B, SER113A, SER113B, SER134A, SER134B, SER136A, SER136B, THR109A, THR109B, TYR111A, TYR111B, TYR132A, TYR132B, TYR140A, TYR147A, TYR147B, VAL83A, VAL83B
• A-C: ALA131A, ALA131C, ALA75A, ALA75C, ARG127A, ARG127C, ARG73A, ARG73C, ASP176A, ASP176C, CYS188A, CYS188C, GLN173A, GLN173C, GLN182A, GLN182C, GLU126A, GLU126C, GLU172A, GLU172C, GLU190A, GLU190C, GLY128A, GLY128C, GLY179A, GLY181A, GLY72A, GLY72C, HIS125A, HIS125C, ILE129A, ILE129C, ILE133A, ILE133C, ILE170A, ILE170C, ILE174A, ILE174C, ILE175A, ILE175C, ILE178A, ILE178C, ILE76A, ILE76C, LEU124A, LEU124C, LYS118A, LYS122A, LYS122C, LYS177A, LYS177C, MET121A, MET121C, MET187A, MET187C, MET191A, MET191C, PRO130A, PRO130C, PRO168A, PRO168C, PRO171A, PRO171C, PRO184A, PRO184C, PRO185A, PRO185C, SER186A, SER186C, SER74A, SER74C, SER77A, SER77C, TYR132A, TYR132C, TYR169C, TYR189A, TYR189C, VAL183A, VAL183C
• A-D: ARG89A, ARG89D, GLN182A, GLN182D, GLY179A, GLY179D, GLY181A, GLY181D, GLY72A, GLY72D, ILE178A, ILE178D, ILE90A, ILE90D, LYS180A, LYS180D, LYS97A, LYS97D, PRO71A, PRO71D
• B-C: ALA88B, ARG73B, ARG89B, ARG89C, GLN182B, GLN182C, GLY179B, GLY179C, GLY181B, GLY181C, GLY72B, GLY72C, ILE178B, ILE178C, ILE90B, ILE90C, LYS177B, LYS180B, LYS180C, LYS97B, PRO71B, PRO91B, VAL183C
• B-D: ALA131B, ALA131D, ALA75B, ALA75D, ARG127B, ARG127D, ARG73B, ARG73D, ASP176B, ASP176D, CYS188B, CYS188D, GLN173B, GLN173D, GLN182B, GLN182D, GLU126B, GLU126D, GLU172B, GLU172D, GLU190B, GLU190D, GLY128B, GLY128D, GLY179B, GLY179D, GLY181D, GLY72B, GLY72D, HIS125B, HIS125D, ILE129B, ILE129D, ILE133B, ILE133D, ILE170B, ILE170D, ILE174B, ILE174D, ILE175B, ILE175D, ILE178B, ILE178D, ILE76B, ILE76D, LEU124B, LEU124D, LYS122B, LYS122D, LYS123D, LYS177B, LYS177D, MET121B, MET121D, MET187B, MET187D, MET191B, MET191D, PRO130B, PRO130D, PRO168B, PRO168D, PRO171B, PRO171D, PRO184B, PRO184D, PRO185B, PRO185D, SER186B, SER186D, SER74B, SER74D, SER77B, SER77D, TYR132B, TYR132D, TYR169B, TYR169D, TYR189B, TYR189D, VAL183B, VAL183D
• C-D: ALA107C, ALA107D, ALA110C, ALA110D, ALA137C, ALA137D, ALA82C, ALA82D, ALA85C, ALA85D, ALA88C, ALA88D, ARG80C, ARG80D, ARG89D, ASN135C, ASN135D, ASN143C, ASN143D, ASN84C, ASN84D, ASP100C, ASP100D, ASP87C, ASP87D, GLU101C, GLU101D, GLU99C, GLU99D, GLY138C, GLY138D, ILE103C, ILE103D, ILE117C, ILE117D, ILE133C, ILE133D, ILE81C, ILE81D, ILE86C, ILE86D, LEU139C, LEU139D, LEU150C, LEU150D, LYS118C, LYS118D, LYS97D, MET121C, MET121D, PHE112C, PHE112D, PRO102C, PRO102D, PRO108C, PRO108D, SER113C, SER113D, SER134C, SER134D, SER136C, SER136D, THR109C, THR109D, TYR111C, TYR111D, TYR132C, TYR140D, TYR147C, TYR147D, VAL83C, VAL83D