3SUA

crystal structure of the intracellular domain of plexin-b1 in complex with rac1

• Total interactions analyzed: 15
• Total true interactions: 9
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 64
  • Norm. En. per Res.: -3.5733
• 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-D	-23.0614	-4.4005	-201.227	-228.6889	64	11	5	7818	0	16	12
A-E	-37.7794	-30.3385	-110.689	-178.8069	54	9	6	5381	1	6	6
B-E	-28.0582	-2.3866	-195.7	-226.1448	67	12	5	7859	0	17	12
B-F	-34.0884	-21.7819	-114.07	-169.9403	56	8	7	5398	1	6	5
C-D	-20.9917	-32.0396	-77.9938	-131.025	42	3	3	3643	3	6	5
C-F	-28.9123	-4.7307	-189.538	-223.1811	64	12	6	7747	0	18	12
D-E	-28.2399	10.8933	-96.5161	-113.8627	49	13	6	3440	0	5	7
D-F	-19.908	10.6024	-77.3417	-86.6473	46	7	5	2997	0	5	6
E-F	-16.4203	9.3819	-67.2054	-74.2438	45	6	6	2908	0	5	5

Interface residues

• A-D: ALA1812D, ALA1845D, ARG1808D, ARG1832D, ARG66A, ARG68A, ASN1834D, ASN39A, ASP1821D, ASP38A, ASP57A, ASP63A, ASP65A, GLN1837D, GLU1806D, GLU1825D, GLU62A, GLY1810D, GLY1813D, HIS103A, HIS104A, HIS1814D, HIS1838D, ILE1777D, ILE1816D, ILE21A, ILE33A, LEU1815D, LEU1817D, LEU1836D, LEU55A, LEU67A, LEU70A, LYS1840D, LYS5A, PHE37A, PRO1842D, PRO34A, PRO69A, PRO73A, SER1809D, SER1818D, SER1824D, SER41A, SER71A, THR17A, THR1823D, THR1835D, THR1846D, THR24A, THR25A, THR35A, THR58A, TRP1807D, TRP56A, TYR1839D, TYR40A, TYR64A, TYR72A, VAL1811D, VAL1822D, VAL1841D, VAL1847D, VAL36A
• A-E: ALA159A, ALA2039E, ALA27A, ALA42A, ARG163A, ARG1741E, ARG1921E, ARG2040E, ASN2034E, ASN26A, ASN39A, ASN43A, ASP1736E, ASP38A, CYS18A, GLN162A, GLU1916E, GLU31A, GLY30A, ILE1914E, ILE1917E, ILE2033E, ILE21A, ILE33A, LEU160A, LEU165A, LEU1739E, LEU1919E, LEU1923E, LEU2036E, LEU2037E, LEU20A, LEU55A, LYS2035E, PHE28A, PHE37A, PRO1915E, PRO2032E, PRO2043E, PRO29A, PRO34A, SER158A, SER22A, SER41A, THR161A, THR17A, THR1920E, THR24A, THR25A, THR35A, TYR1918E, TYR23A, TYR32A, TYR40A
• B-E: ALA1812E, ALA1845E, ARG1808E, ARG1832E, ARG66B, ARG68B, ASN1834E, ASN39B, ASP1821E, ASP38B, ASP57B, ASP63B, ASP65B, GLN1837E, GLN74B, GLU1806E, GLU1825E, GLU62B, GLY1810E, GLY1813E, HIS103B, HIS104B, HIS1814E, HIS1838E, ILE1777E, ILE1816E, ILE21B, ILE33B, LEU1815E, LEU1817E, LEU1836E, LEU1853E, LEU20B, LEU55B, LEU67B, LEU70B, LYS1840E, LYS5B, PHE37B, PRO1842E, PRO34B, PRO69B, PRO73B, SER1809E, SER1818E, SER1824E, SER41B, SER71B, THR17B, THR1823E, THR1835E, THR1846E, THR24B, THR25B, THR35B, THR58B, TRP1807E, TRP56B, TYR1839E, TYR40B, TYR64B, TYR72B, VAL1811E, VAL1822E, VAL1841E, VAL1847E, VAL36B
• B-F: ALA159B, ALA1913F, ALA2039F, ALA27B, ALA42B, ARG163B, ARG1741F, ARG1921F, ARG2040F, ASN2034F, ASN26B, ASN39B, ASN43B, ASP118B, ASP1736F, ASP38B, CYS18B, GLN162B, GLU1916F, GLU31B, GLY30B, ILE1914F, ILE1917F, ILE2033F, ILE21B, ILE33B, LEU160B, LEU165B, LEU1739F, LEU1919F, LEU1923F, LEU2036F, LEU2037F, LEU20B, LEU55B, LYS2035F, PHE28B, PHE37B, PRO1915F, PRO2032F, PRO2043F, PRO29B, PRO34B, SER158B, SER22B, SER41B, THR161B, THR17B, THR1920F, THR24B, THR25B, THR35B, TYR1918F, TYR23B, TYR32B, TYR40B
• C-D: ALA2039D, ALA27C, ALA42C, ARG1741D, ARG1921D, ARG2040D, ASN26C, ASN39C, ASN43C, ASP1736D, ASP38C, CYS18C, GLU1916D, GLU31C, GLY30C, ILE1917D, ILE2033D, ILE21C, ILE33C, LEU160C, LEU1739D, LEU1919D, LEU1923D, LEU2036D, LEU2037D, LEU55C, LYS2035D, PHE28C, PHE37C, PRO2032D, PRO2043D, PRO29C, SER22C, SER41C, THR17C, THR1920D, THR24C, THR25C, THR35C, TYR1918D, TYR32C, TYR40C
• C-F: ALA1812F, ALA1845F, ARG1808F, ARG1832F, ARG66C, ARG68C, ASN1834F, ASN39C, ASP1821F, ASP38C, ASP57C, ASP63C, ASP65C, GLN1837F, GLU1806F, GLU1825F, GLU62C, GLY1810F, GLY1813F, HIS103C, HIS104C, HIS1814F, HIS1838F, ILE1777F, ILE1816F, ILE21C, ILE33C, LEU1815F, LEU1817F, LEU20C, LEU55C, LEU67C, LEU70C, LYS1840F, LYS5C, PHE37C, PRO1842F, PRO34C, PRO69C, PRO73C, SER1809F, SER1818F, SER1824F, SER41C, SER71C, THR17C, THR1823F, THR1835F, THR1846F, THR24C, THR25C, THR35C, THR58C, TRP1807F, TRP56C, TYR1839F, TYR40C, TYR64C, TYR72C, VAL1811F, VAL1822F, VAL1841F, VAL1847F, VAL36C
• D-E: ALA1756D, ALA1764D, ALA1812D, ALA1848D, ALA2039E, ARG1808D, ARG2040E, ARG2044E, ARG2047E, ARG2051E, ASN1752D, ASP1934E, ASP1935E, ASP2041E, GLN1765D, GLN1930E, GLN1938E, GLU1806D, GLY1766D, GLY1810D, GLY1813D, GLY1927E, HIS1814D, ILE1917E, ILE2033E, LEU1754D, LEU1755D, LEU1919E, LEU1922E, LEU1923E, LEU1929E, LEU1936E, LEU2036E, LEU2037E, LYS1926E, LYS1931E, LYS2035E, MET2048E, PHE1932E, PRO2043E, SER1809D, THR1846D, THR1920E, TRP1807D, TYR2038E, TYR2045E, VAL1757D, VAL1811D, VAL1933E
• D-F: ALA1756F, ALA1764F, ALA1812F, ALA1848F, ALA2039D, ARG1808F, ARG2040D, ARG2044D, ARG2051D, ASN1752F, ASP1934D, ASP1935D, ASP2041D, GLN1765F, GLN1930D, GLN1938D, GLU1806F, GLY1766F, GLY1810F, GLY1813F, GLY1927D, HIS1814F, ILE1917D, LEU1754F, LEU1815F, LEU1919D, LEU1922D, LEU1923D, LEU1936D, LEU2036D, LEU2037D, LYS1926D, LYS1931D, LYS2035D, MET2048D, PHE1932D, PRO1768F, SER1809F, THR1846F, THR1920D, TRP1807F, TYR2038D, TYR2045D, VAL1757F, VAL1811F, VAL1933D
• E-F: ALA1756E, ALA1764E, ALA1812E, ALA2039F, ARG1808E, ARG2040F, ARG2044F, ARG2047F, ARG2051F, ASN1752E, ASP1934F, ASP1935F, ASP2041F, GLN1765E, GLN1930F, GLN1938F, GLY1766E, GLY1810E, GLY1813E, GLY1927F, HIS1814E, ILE1917F, ILE2033F, LEU1754E, LEU1919F, LEU1922F, LEU1923F, LEU1936F, LEU2036F, LEU2037F, LYS1926F, LYS1931F, LYS2035F, MET2048F, PHE1932F, PRO2043F, SER1809E, THR1846E, THR1920F, TRP1807E, TYR2038F, TYR2045F, VAL1757E, VAL1811E, VAL1933F