1BBP

molecular structure of the bilin binding protein (bbp) from pieris brassicae after refinement at 2.0 angstroms resolution.

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 79
  • Norm. En. per Res.: -4.0211
• 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	-6.1672	2.1534	-89.0772	-93.0911	56	5	3	4717	0	11	14
A-C	-22.4545	-53.2602	-241.951	-317.6656	79	9	2	9241	5	55	45
B-C	-13.9108	11.4001	-44.8723	-47.3829	36	5	0	2194	0	8	8
B-D	-12.6908	-51.0851	-242.126	-305.9019	78	9	2	9023	5	54	45
C-D	-19.7083	4.7817	-94.269	-109.1957	59	2	3	4668	0	13	15

Interface residues

• A-B: ALA145B, ALA148B, ALA173B, ALA31A, ALA31B, ARG137B, ASN112B, ASN151A, ASP161A, ASP169A, ASP169B, CYS175B, GLN163A, GLU144B, GLU150A, GLU150B, GLU172B, GLY143B, GLY155A, ILE154A, LEU141A, LEU141B, LEU153A, LEU165A, LYS111B, LYS139A, LYS139B, LYS146A, LYS146B, LYS164A, LYS32A, PHE170A, PHE170B, PRO34A, SER136B, SER138B, SER156A, SER162A, SER168A, SER168B, SER171B, THR142A, THR142B, THR147A, THR147B, TRP28B, TYR152A, TYR167A, TYR167B, VAL134A, VAL140A, VAL140B, VAL149A, VAL166A, VAL30A, VAL30B
• A-C: ASN178A, ASN2A, ASN2C, ASN35A, ASN35C, ASP122A, ASP122C, ASP124A, ASP124C, ASP130A, ASP130C, ASP169A, ASP169C, ASP6A, ASP6C, CYS119A, CYS119C, GLN129A, GLN129C, GLN163A, GLN163C, GLU123A, GLU123C, GLU38A, GLU38C, GLY127A, GLY127C, GLY41A, GLY41C, GLY65A, GLY7A, GLY7C, HIS128A, HIS128C, HIS5A, HIS5C, HIS61A, HIS61C, HIS64A, HIS64C, ILE63A, ILE63C, LYS120A, LYS120C, LYS125A, LYS125C, LYS126A, LYS126C, LYS164A, LYS164C, LYS32A, LYS32C, LYS39A, LYS39C, LYS42A, LYS42C, LYS66A, LYS66C, PHE131A, PHE131C, PRO34A, PRO34C, SER36A, SER36C, TYR121A, TYR121C, TYR33C, TYR40A, TYR40C, TYR4A, TYR4C, TYR68A, TYR68C, VAL166A, VAL166C, VAL37A, VAL37C, VAL3A, VAL3C
• B-C: ASN151B, ASN151C, ASP161B, ASP161C, GLN163B, GLN163C, GLU150B, GLU150C, GLY155B, GLY155C, HIS5B, HIS5C, ILE154B, ILE154C, LEU153B, LEU153C, LEU165B, LEU165C, LYS146C, LYS164B, LYS164C, PRO157B, PRO157C, SER156B, SER156C, SER162B, SER162C, TYR167B, TYR167C, TYR33B, TYR33C, VAL158B, VAL158C, VAL159B, VAL159C, VAL3B
• B-D: ALA8B, ALA8D, ASN2B, ASN2D, ASN35B, ASN35D, ASP122B, ASP122D, ASP124B, ASP124D, ASP130B, ASP130D, ASP169B, ASP169D, ASP6B, ASP6D, GLN129B, GLN129D, GLN163B, GLN163D, GLU123B, GLU123D, GLU38B, GLU38D, GLY127B, GLY127D, GLY41B, GLY41D, GLY7B, GLY7D, HIS128B, HIS128D, HIS5B, HIS5D, HIS61B, HIS61D, HIS64B, HIS64D, ILE63B, ILE63D, LYS120B, LYS120D, LYS125B, LYS125D, LYS126B, LYS126D, LYS164B, LYS164D, LYS32B, LYS32D, LYS39B, LYS39D, LYS42B, LYS42D, LYS66B, LYS66D, PHE131B, PHE131D, PRO34B, PRO34D, SER36B, SER36D, TYR121B, TYR121D, TYR33B, TYR33D, TYR40B, TYR40D, TYR4B, TYR4D, TYR68B, TYR68D, VAL166B, VAL166D, VAL37B, VAL37D, VAL3B, VAL3D
• C-D: ALA145C, ALA148C, ALA173C, ALA174C, ALA31C, ALA31D, ARG137C, ASN112C, ASN151D, ASP161D, ASP169C, ASP169D, CYS175C, GLN163D, GLU144C, GLU150C, GLU150D, GLU172C, GLY143C, GLY155D, ILE154D, LEU141C, LEU141D, LEU153D, LEU165D, LYS111C, LYS139C, LYS139D, LYS146C, LYS146D, LYS164D, LYS32D, PHE170C, PHE170D, PRO34D, SER136C, SER138C, SER156D, SER162D, SER168C, SER168D, SER171C, SER171D, THR142C, THR142D, THR147C, THR147D, TRP28C, TYR152D, TYR167C, TYR167D, TYR33D, VAL134D, VAL140C, VAL140D, VAL149D, VAL166D, VAL30C, VAL30D