2H0B

crystal structure of the second lns/lg domain from neurexin 1 alpha

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 35
  • Norm. En. per Res.: -2.4226
• 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	-4.8024	2.1801	-83.1759	-85.7983	56	3	0	3445	0	15	9
B-D	-12.7984	-24.8867	-47.1051	-84.7903	35	1	0	2026	3	16	14
C-D	-20.8937	-5.2291	-34.6426	-60.7654	44	2	0	1881	0	8	7

Interface residues

• A-B: ALA328A, ARG317B, ARG374A, ARG377A, ASN299A, ASN345A, ASN363B, ASN365B, ASN439B, ASN440B, ASP295A, ASP329A, ASP411A, ASP418A, ASP419A, CYS444B, GLN298A, GLN302A, GLN316B, GLU290B, GLY288B, GLY325A, GLY347A, GLY416A, GLY443B, GLY474B, HIS473B, ILE301A, ILE472B, LEU296A, LEU315B, LEU346A, LEU376A, LEU415A, LYS287B, LYS313B, LYS326A, PHE286B, PHE292B, PHE420A, PRO300A, PRO433A, SER289B, SER297A, SER303A, SER304A, SER327A, SER348A, SER417A, THR285B, THR314B, THR413A, TYR291B, TYR330A, TYR412A, VAL475B
• B-D: ARG374B, ARG456B, ARG461B, ASN299D, ASN375B, ASN452B, ASN453B, ASP295D, ASP306B, ASP454B, ASP467D, CYS293D, GLN298D, GLN465B, GLU280B, GLU307B, GLU447B, GLU458B, GLY466D, HIS473D, ILE472D, LEU457B, LYS451B, LYS469D, LYS471D, PRO468D, SER297D, SER305B, THR373B, TYR282B, TYR294D, TYR450B, VAL449B, VAL455B, VAL475D
• C-D: ALA430D, ARG317D, ARG374C, ARG377C, ASN318D, ASN337D, ASN375C, ASN439D, ASN440D, ASN452C, ASN453C, ASP306C, ASP431D, ASP454C, GLN316D, GLN378C, GLU290D, GLU307C, GLY288D, GLY319D, GLY400C, GLY474D, LEU315D, LEU376C, LYS287D, LYS336D, LYS371C, LYS451C, PRO427D, PRO436D, SER289D, SER304C, SER305C, SER397C, SER428D, SER438D, THR373C, THR395C, THR403C, THR405C, THR413C, THR429D, TYR407C, VAL437D