2V1D

structural basis of lsd1-corest selectivity in histone h3 recognition

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 108
  • Norm. En. per Res.: -4.2169
• 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	-45.1107	-99.1777	-602.482	-746.7704	202	32	27	27636	8	74	75
A-C	-60.9121	-150.8632	-243.652	-455.4273	108	35	4	11192	9	29	25
B-C	0.0	0.0	-0.009	-0.009	3	0	0	10	0	0	0

Interface residues

• A-B: ALA323B, ALA326B, ALA328B, ALA330B, ALA331B, ALA358B, ALA388A, ALA391B, ALA394B, ALA404B, ALA476A, ALA489A, ALA498A, ARG308B, ARG336B, ARG347B, ARG371B, ARG384A, ARG396B, ARG485A, ASN327B, ASN351B, ASN356B, ASN383A, ASN402A, ASN411B, ASN446A, ASN450A, ASP320B, ASP339B, ASP364B, ASP397A, ASP401B, ASP407B, ASP425A, ASP473A, ASP486A, ASP495A, ASP518A, CYS491A, GLN318B, GLN337B, GLN348B, GLN350B, GLN354B, GLN377B, GLN380A, GLN388B, GLN393B, GLN395A, GLN403B, GLN410A, GLN417A, GLN419A, GLN427A, GLN438A, GLN460A, GLN501A, GLN509A, GLU319B, GLU322B, GLU341B, GLU361B, GLU368B, GLU374B, GLU381A, GLU386B, GLU387A, GLU387B, GLU413A, GLU420A, GLU426A, GLU429A, GLU439A, GLU440A, GLU443A, GLU453A, GLU457A, GLU477A, GLU493A, GLU496A, GLU505A, GLU512A, GLY313B, GLY365B, GLY366B, GLY410B, HIS422A, HIS430A, HIS459A, HIS484A, ILE349B, ILE352B, ILE367B, ILE395B, ILE405B, ILE409B, ILE416A, ILE428A, ILE434A, ILE455A, ILE474A, LEU316B, LEU335B, LEU338B, LEU342B, LEU359B, LEU363B, LEU372B, LEU385A, LEU386A, LEU389B, LEU390B, LEU392A, LEU396A, LEU401A, LEU418A, LEU441A, LEU444A, LEU445A, LEU451A, LEU458A, LEU479A, LEU487A, LEU490A, LEU497A, LEU504A, LEU508A, LYS309B, LYS312B, LYS346B, LYS353B, LYS360B, LYS362B, LYS397B, LYS421A, LYS424A, LYS432A, LYS433A, LYS436A, LYS442A, LYS447A, LYS452A, LYS454A, LYS456A, LYS463A, LYS481A, LYS483A, LYS492A, MET314B, MET340B, MET448A, PHE315B, PHE382A, PHE398A, PHE478A, PRO310B, PRO311B, PRO369B, PRO373B, PRO515A, PRO516A, SER317B, SER325B, SER344B, SER357B, SER390A, SER393A, SER406B, SER466A, SER482A, THR329B, THR332B, THR355B, THR384B, THR385B, THR389A, THR437A, THR475A, THR488A, TRP431A, TYR370B, TYR391A, TYR398B, TYR462A, TYR494A, TYR520A, VAL321B, VAL324B, VAL334B, VAL343B, VAL345B, VAL375B, VAL392B, VAL400A, VAL408B, VAL414A, VAL415A, VAL423A, VAL435A, VAL449A, VAL480A
• A-C: ALA15C, ALA1C, ALA331A, ALA388A, ALA534A, ALA539A, ALA541A, ALA7C, ALA809A, ARG2C, ARG384A, ARG8C, ASN383A, ASN535A, ASN540A, ASN676A, ASN806A, ASP375A, ASP553A, ASP555A, ASP556A, ASP557A, CYS360A, GLN358A, GLN380A, GLN554A, GLN5C, GLU376A, GLU379A, GLU387A, GLU537A, GLU559A, GLU801A, GLY12C, GLY13C, GLY336A, GLY562A, GLY679A, GLY813A, HIS394A, HIS532A, HIS551A, HIS564A, HIS812A, ILE356A, ILE528A, LEU362A, LEU385A, LEU386A, LEU408A, LEU536A, LEU544A, LEU547A, LEU565A, LEU659A, LEU677A, LEU693A, LEU697A, LEU706A, LYS14C, LYS357A, LYS359A, LYS372A, LYS374A, LYS9C, MET332A, MET377A, MET4C, PHE382A, PHE533A, PHE538A, PHE558A, PHE560A, PHE678A, PHE692A, PHE694A, PRO16C, PRO361A, PRO808A, SER10C, SER390A, SER563A, SER760A, SER762A, THR11C, THR335A, THR389A, THR3C, THR542A, THR561A, THR566A, THR6C, THR810A, TRP531A, TRP552A, TRP695A, TYR391A, TYR571A, TYR761A, TYR763A, TYR773A, TYR807A, VAL333A, VAL334A, VAL370A, VAL378A, VAL764A, VAL811A
• B-C: GLY12C, GLY13C, PRO311B