2H63

crystal structure of human biliverdin reductase a (casp target)

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 107
  • Norm. En. per Res.: -2.6068
• 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	-13.8858	-58.9634	-39.7156	-112.5648	47	2	0	2363	4	18	10
A-C	-8.5355	-10.5814	-259.81	-278.9269	107	9	6	10428	0	18	30
A-D	0.0	1.0172	-17.7226	-16.7054	22	1	0	961	0	11	15
B-D	-6.7754	-16.9374	-219.468	-243.1808	105	7	6	9392	0	20	30

Interface residues

• A-B: ALA154A, ALA62B, ARG161A, ARG18A, ARG225A, ARG25A, ARG28B, ARG7B, ASN226A, ASN38B, ASP52B, ASP61B, GLN197A, GLN55B, GLN56B, GLN66B, GLU158A, GLU160A, GLU67B, GLU69B, GLY155A, GLY220A, GLY222A, GLY41B, GLY49B, GLY53B, ILE40B, ILE57B, LEU157A, LEU223A, LEU37B, LEU39B, LYS224A, LYS8B, PHE152A, PHE162A, PHE42B, PRO156A, PRO221A, SER58B, SER64B, SER65B, VAL12B, VAL22A, VAL246A, VAL54B, VAL68B
• A-C: ALA134A, ALA134C, ALA35A, ALA35C, ARG7A, ARG7C, ASN240C, ASN243A, ASN243C, ASN247A, ASN247C, ASN249A, ASN249C, ASN256A, ASN256C, ASN29A, ASN29C, GLN255A, GLN255C, GLN260A, GLN260C, GLN265A, GLN265C, GLU131A, GLU131C, GLU132A, GLU132C, GLU139A, GLU139C, GLU239C, GLY142A, GLY142C, GLY236A, GLY236C, GLY245A, GLY245C, GLY264A, GLY264C, HIS31A, HIS31C, ILE257A, ILE257C, LEU136A, LEU136C, LEU179A, LEU238A, LEU238C, LEU252A, LEU252C, LEU262A, LEU262C, LEU263A, LEU263C, LEU37A, LEU37C, LYS137A, LYS137C, LYS138A, LYS138C, LYS143A, LYS143C, LYS248A, LYS248C, LYS253A, LYS253C, LYS261A, LYS261C, LYS8A, LYS8C, MET130A, MET130C, MET6A, PHE133A, PHE133C, PHE135A, PHE135C, PHE258A, PHE266A, PHE266C, PHE36A, PHE36C, PHE9A, PRO242A, PRO242C, PRO30A, PRO30C, PRO32A, PRO32C, SER235A, SER237A, SER237C, SER33A, SER33C, SER34A, SER34C, VAL140A, VAL140C, VAL141A, VAL141C, VAL241A, VAL241C, VAL244A, VAL244C, VAL246A, VAL246C, VAL259A, VAL259C
• A-D: ARG161A, ARG45A, ARG46A, ASN240D, ASP144D, GLN197A, GLU158A, GLU160A, GLU239D, GLU47A, GLU76A, GLY142D, GLY236D, LEU146D, LEU238D, LYS143D, LYS234D, PHE233D, PRO242D, SER235D, SER237D, SER44A
• B-D: ALA134B, ALA134D, ALA35B, ALA35D, ARG7B, ARG7D, ASN240B, ASN240D, ASN243B, ASN243D, ASN247B, ASN249B, ASN249D, ASN256B, ASN256D, ASN29B, ASN29D, GLN255B, GLN255D, GLN260B, GLN260D, GLN265B, GLN265D, GLU131B, GLU131D, GLU132B, GLU132D, GLU139B, GLU139D, GLU239D, GLY142B, GLY142D, GLY236D, GLY245B, GLY245D, GLY264B, GLY264D, HIS31B, HIS31D, ILE257B, ILE257D, LEU136B, LEU136D, LEU238B, LEU238D, LEU252B, LEU252D, LEU262B, LEU262D, LEU263B, LEU263D, LEU37B, LEU37D, LYS137B, LYS137D, LYS138B, LYS138D, LYS143B, LYS143D, LYS248B, LYS248D, LYS253B, LYS253D, LYS261B, LYS261D, LYS8B, LYS8D, MET130B, MET130D, MET6D, PHE133B, PHE133D, PHE135B, PHE135D, PHE258B, PHE258D, PHE266B, PHE266D, PHE36B, PHE36D, PRO242B, PRO242D, PRO30B, PRO30D, PRO32B, PRO32D, SER235D, SER237B, SER237D, SER33B, SER33D, SER34B, SER34D, VAL140B, VAL140D, VAL141B, VAL141D, VAL241B, VAL241D, VAL244B, VAL244D, VAL246B, VAL246D, VAL259B, VAL259D