3I4W

crystal structure of the third pdz domain of psd-95

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 49
  • Norm. En. per Res.: -2.9948
• 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	-53.4985	26.5705	-119.819	-146.747	49	8	0	4346	2	27	25
A-C	-3.6609	-33.7201	-102.909	-140.29	64	1	2	4777	2	14	11
A-D	0.0	0.0	-3.5625	-3.5625	15	0	0	357	0	8	7
B-C	0.0	0.3248	-22.8917	-22.5669	30	2	0	1061	0	6	3
B-D	-3.5987	-26.0405	-98.509	-128.1482	60	2	3	4531	2	13	13

Interface residues

• A-B: ALA370B, ALA375B, ALA376B, ALA402B, ARG309A, ARG354A, ARG368B, ARG399A, ARG399B, ASN369B, ASP306A, CB4.8973626.57374, GLN358B, GLN374B, GLN391A, GLU305A, GLU305A5, GLU310A, GLU331B, GLU334B, GLU373B, GLU395A, GLU396A, GLU396B, GLU401B, GLY329B, GLY330B, GLY333B, GLY335B, GLY356A, HIS372B, ILE307A, ILE327B, ILE336B, ILE377B, LEU367B, LYS393A, PHE337A, PHE337B, PHE400B, PRO308A, PRO394A, SER339B, SER371B, SER398A, TYR392A, TYR397A, TYR397B, VAL328B
• A-C: ALA343C, ALA376C, ALA382C, ALA390A, ARG309A, ARG312A, ARG313A, ARG318C, ARG368A, ASN326C, ASN363A, ASN381C, ASP306A, ASP348C, ASP366A, GLN358A, GLN384C, GLN391A, GLU305A, GLU310A, GLU373C, GLU401C, GLY319C, GLY322C, GLY324C, GLY329C, GLY344C, GLY345C, GLY364A, GLY383C, HIS372C, ILE307A, ILE314A, ILE327C, ILE341C, ILE359A, ILE377C, ILE388A, ILE389A, LEU323C, LEU342C, LEU349C, LEU360A, LEU367A, LEU379C, LYS355C, LYS380C, LYS393A, PHE325C, PHE340C, PRO308A, PRO311A, PRO346C, SER320C, SER339C, SER361A, THR321C, THR387A, TYR397C, VAL315A, VAL328C, VAL362A, VAL365A, VAL386C
• A-D: ALA402A, ARG313D, ARG399A, GLU352D, GLU395A, GLU401A, HIS317D, ILE316D, LEU349D, LYS355A, PHE400A, PRO346D, SER350D, SER398A, VAL315D
• B-C: ALA370B, ALA376C, ALA382C, ARG318C, ARG368B, ASN369B, ASN381C, ASP366B, GLN358B, GLN374B, GLN384C, GLU331B, GLU334B, GLU396B, GLY319C, GLY322C, GLY333B, GLY383C, ILE377C, LEU323C, LEU360B, LEU379C, LYS380C, LYS393B, PHE400B, SER320C, SER371B, THR321C, THR385C, VAL386C
• B-D: ALA343B, ALA376B, ALA390D, ARG309D, ARG312D, ARG313D, ARG318B, ARG368D, ASN326B, ASN363D, ASN381B, ASP306D, ASP348B, ASP366D, GLN358D, GLN384B, GLN391D, GLU305D, GLU310D, GLU373B, GLU401B, GLY319B, GLY322B, GLY324B, GLY329B, GLY344B, GLY345B, GLY364D, GLY383B, HIS372B, ILE307D, ILE314D, ILE327B, ILE338B, ILE341B, ILE388D, ILE389D, LEU323B, LEU342B, LEU360D, LEU367D, LEU379B, LYS355B, LYS380B, LYS393D, PHE325B, PHE340B, PRO308D, PRO311D, PRO346B, SER320B, SER339B, SER361D, THR321B, THR387D, TYR397B, VAL315D, VAL328B, VAL362D, VAL365D