3SBW

crystal structure of the complex between the extracellular domains of mouse pd-1 mutant and human pd-l1

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 88
  • Norm. En. per Res.: -3.3994
• Hub Node: A(2)

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	-41.1462	0.2859	-144.803	-185.6634	61	5	5	5710	1	10	11
A-C	0.0	0.0	-0.0132	-0.0132	3	0	0	12	0	0	0
B-C	-37.2884	-60.8757	-200.983	-299.1471	88	16	5	9135	3	22	25

Interface residues

• A-B: ALA140A, ALA40A, ALA48B, ALA50B, ALA93B, ARG114B, ARG69A, ARG94B, ASN109B, ASN49B, ASN68A, ASN74A, ASP112B, ASP92B, CYS123A, GLN75A, GLN88B, GLN91B, GLN96B, GLU135A, GLU136A, GLU141A, GLU46B, GLY119A, GLY124A, GLY139A, GLY47B, ILE110B, ILE120A, ILE97B, ILE98B, LEU111B, LEU122A, LEU142A, LEU35A, LEU42A, LEU70A, LEU86B, PHE37A, PHE52A, PHE95B, PRO138A, PRO39A, PRO72A, PRO89B, SER137A, SER45B, SER71A, SER73A, SER87B, THR113B, THR145A, THR36A, THR43A, THR76A, TRP41A, TYR121A, TYR38A, VAL143A, VAL44B, VAL90B
• A-C: ALA40A, MET18C, TRP41A
• B-C: ALA121C, ALA125B, ALA52C, ALA80B, ALA81B, ARG113C, ARG125C, ARG69B, ASN63C, ASN66B, ASN68B, ASN74B, ASP122C, ASP26C, ASP61C, ASP73C, CYS114C, CYS123B, CYS40C, GLN66C, GLN75B, GLN79B, GLN88B, GLN91B, GLU135B, GLU136B, GLU58C, GLU77B, GLY119C, GLY120C, GLY124B, GLY139B, HIS129B, HIS69C, ILE116C, ILE120B, ILE126B, ILE126C, ILE134B, ILE54C, ILE65C, ILE97B, LEU122B, LEU128B, LEU132B, LEU27C, LEU65B, LEU70B, LYS124C, LYS131B, LYS133B, LYS25C, LYS78B, MET115C, MET18C, MET59C, MET64B, PHE19C, PHE67C, PHE82B, PRO130B, PRO24C, PRO72B, PRO89B, SER117C, SER127B, SER137B, SER71B, SER73B, SER83B, SER87B, THR127C, THR20C, THR22C, THR76B, TRP57C, TRP67B, TYR112C, TYR118C, TYR123C, TYR56C, VAL111C, VAL21C, VAL23C, VAL55C, VAL68C, VAL76C, VAL90B