3NA2

crystal structure of protein of unknown function from mine drainage metagenome leptospirillum rubarum

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 52
  • Norm. En. per Res.: -3.5484
• 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	-5.7954	-52.0412	-57.6704	-115.507	51	0	0	3064	4	9	5
A-C	-70.6783	-20.9175	-92.9229	-184.5187	52	9	2	4028	3	21	14
A-D	-6.2736	29.8465	-80.5212	-56.9483	39	4	1	3344	0	13	15
B-D	-58.1294	6.1703	-89.01	-140.9691	42	7	2	3683	2	25	13
C-D	0.0	-40.5692	-99.4914	-140.0606	53	7	2	4755	2	9	11

Interface residues

• A-B: ALA117B, ARG121B, ARG132B, ARG134B, ARG18B, ARG82A, ASN78A, ASP77A, GLN114B, GLN120B, GLN135A, GLU107A, GLU107B, GLU113A, GLU113B, GLU15B, GLU39B, GLY140A, GLY20B, GLY38B, GLY79A, GLY80A, ILE123B, ILE81A, LEU136A, LEU73A, LYS76A, PHE115B, PHE118B, PHE138A, PHE138B, PHE17B, PRO102A, PRO106A, PRO106B, PRO109A, PRO109B, PRO111A, PRO112A, PRO139A, PRO75A, SER110A, SER110B, SER74A, THR108A, THR108B, THR19B, TRP100B, TRP116B, VAL137A, VAL137B
• A-C: ALA40A, ALA40C, ARG121A, ARG121C, ARG18A, ARG18C, ARG41A, ARG41C, ARG8A, ARG8C, ASP7A, ASP7C, GLN11A, GLN11C, GLU15A, GLU15C, GLU39A, GLU39C, GLU44A, GLU44C, GLU53A, GLU53C, GLY10A, GLY10C, GLY38A, GLY38C, GLY47A, GLY47C, GLY4A, GLY4C, ILE45A, ILE45C, LEU14A, LEU14C, LEU50A, LEU50C, LYS42A, LYS42C, PRO3A, SER49A, SER49C, THR46A, THR46C, THR48A, THR48C, THR51A, THR51C, THR6A, THR6C, TYR122C, VAL43A, VAL43C
• A-D: ALA117A, ALA117D, ARG121A, ARG121D, ARG132A, ARG132D, ARG134A, ARG134D, ARG8A, ARG8D, ASP124A, ASP124D, ASP130A, ASP130D, ASP7A, ASP7D, GLN11A, GLN11D, GLN120A, GLN120D, GLN135A, GLN135D, GLY140A, GLY4A, ILE123A, ILE123D, LEU125A, LEU125D, PHE118A, PHE138A, PHE138D, PHE71A, THR119A, THR119D, TRP116A, TRP116D, TYR122A, TYR122D, VAL5A
• B-D: ALA40B, ALA40D, ARG18B, ARG18D, ARG41B, ARG41D, ASP7B, ASP7D, GLN11B, GLN11D, GLU15B, GLU15D, GLU39B, GLU39D, GLU44B, GLU44D, GLU53B, GLU53D, GLY10B, GLY10D, GLY47B, GLY47D, GLY4D, ILE45B, ILE45D, LEU14B, LEU14D, LEU50B, LEU50D, LYS42B, LYS42D, PRO3D, SER49B, SER49D, THR46B, THR46D, THR48B, THR48D, THR51B, THR51D, VAL43B, VAL43D
• C-D: ALA117C, ARG121C, ARG132C, ARG134C, ARG134D, ARG18C, ARG82D, ARG8C, ASN133D, ASN78D, ASP124C, ASP130C, ASP77D, GLN114C, GLN114D, GLN11C, GLN120C, GLN135D, GLU107C, GLU107D, GLU113C, GLU113D, GLU15C, GLY20C, GLY79D, GLY80D, ILE123C, ILE81D, LEU136D, LYS76D, PHE115C, PHE118C, PHE138D, PRO106C, PRO106D, PRO109C, PRO109D, PRO111D, PRO112D, PRO139D, PRO75D, SER110C, SER110D, SER74D, THR108C, THR108D, THR119C, THR19C, TRP100C, TRP116C, TRP116D, TYR122C, VAL137D