NMR Restraints Grid

Result table
(Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype

650225 6wqe 27284 cing 1-original 2 XPLOR/CNS distance NOE simple
# Restraints file 2: alt.tbl
# IWP051 intraNOEs
assign (residue 501 and name H03) (residue 501 and name H09*) 4.50 2.00 0.5
assign (residue 501 and name H01) (residue 501 and name H09*) 5.50 3.00 0.5
assign (residue 501 and name H07) (residue 501 and name H08) 5.00 1.90 0.5
assign (residue 501 and name H07) (residue 501 and name H09*) 5.00 2.00 0.0
assign (residue 501 and name H05) (residue 501 and name H07) 3.10 0.50 0.25
assign (residue 501 and name H06) (residue 501 and name H07) 5.00 1.00 0.50
# protein-iwp interNOEs
assign (residue 12 and name HB1) (residue 501 and name H02) 6.50 2.90 0.5
assign (residue 12 and name HB2) (residue 501 and name H02) 6.50 2.90 0.5
assign (residue 12 and name HD1*) (residue 501 and name H01) 6.00 2.50 0.5
assign (residue 12 and name HD1*) (residue 501 and name H02) 6.00 2.90 0.5
assign (residue 12 and name HD2*) (residue 501 and name H01) 6.0 3.50 0.5
assign (residue 12 and name HD2*) (residue 501 and name H04) 6.0 2.90 0.5
assign (residue 16 and name HA) (residue 501 and name H04)  6.50 2.90 0.5
assign (residue 16 and name HB1) (residue 501 and name H04) 6.50 2.90 0.5
assign (residue 16 and name HG1) (residue 501 and name H01) 6.50 2.90 0.5
assign (residue 16 and name HG1) (residue 501 and name H03) 6.50 2.50 0.5
assign (residue 16 and name HG1) (residue 501 and name H04) 5.50 1.90 0.5
assign (residue 61 and name HG2*) (residue 501 and name H02) 6.50 1.50 1.0
assign (residue 66 and name HD1*) (residue 501 and name H02) 6.50 1.50 1.0
assign (residue 66 and name HD1*) (residue 501 and name H04) 7.00 1.50 1.0
assign (residue 66 and name HD1*) (residue 501 and name H01) 6.50 1.50 1.0
assign (residue 69 and name HA) (residue 501 and name H01) 6.00 2.00 0.5
assign (residue 69 and name HA) (residue 501 and name H03) 6.50 2.00 0.5
assign (residue 69 and name HB2) (residue 501 and name H01) 5.00 1.50 0.5
assign (residue 69 and name HB2) (residue 501 and name H02) 5.00 1.50 0.5
assign (residue 69 and name HD1*) (residue 501 and name H03) 5.00 1.50 0.5
assign (residue 73 and name HB2) (residue 501 and name H01) 6.50 2.50 1.0
assign (residue 73 and name HB2) (residue 501 and name H03) 6.50 2.50 1.0
assign (residue 73 and name HE1) (residue 501 and name H01) 6.50 2.50 1.0
assign (residue 73 and name HE1) (residue 501 and name H03) 6.50 2.50 1.0
# Heme NOEs
assign (residue 500 and name HB) (residue 500 and name HMA*) 3.60 1.60 0.5
assign (residue 500 and name HB) (residue 500 and name HMB*) 3.60 1.60 0.5
assign (residue 500 and name HD) (residue 500 and name HMD*) 3.60 1.60 0.5
assign (residue 500 and name HD) (residue 500 and name HAC) 3.30 1.00 0.5
assign (residue 500 and name HD) (residue 500 and name HBC2) 3.20 0.50 0.5
assign (residue 500 and name HC) (residue 500 and name HAB) 3.0 0.60 0.5
assign (residue 500 and name HC) (residue 500 and name HMC*) 3.60 1.60 0.5
assign (residue 500 and name HMD*) (residue 500 and name HAC) 4.60 1.90 0.5
assign (residue 500 and name HMC*) (residue 500 and name HBC2) 4.60 2.50 0.5
assign (residue 500 and name HMC*) (residue 500 and name HBC1) 4.60 2.50 0.5
assign (residue 500 and name HMB*) (residue 500 and name HBB1) 4.60 2.50 0.5
assign (residue 500 and name O1A) (residue 500 and name O2D) 6.80 0.50 0.5
assign (residue 500 and name O1A) (residue 500 and name O1D) 6.80 0.50 0.5
assign (residue 500 and name O2A) (residue 500 and name O2D) 6.80 0.50 0.5
assign (residue 500 and name O2A) (residue 500 and name O1D) 6.80 0.50 0.5
assign (residue  1 and name N) (residue 500 and name O1D) 5.0 0.3 0.0
assign (residue  1 and name N) (residue 500 and name O2D) 5.0 0.3 0.0
assign (residue  1 and name HE*) (residue 500 and name HMD*) 5.6 1.4 1.0
assign (residue  1 and name HE*) (residue 500 and name HBC2) 5.6 1.4 1.0
assign (residue  1 and name HB*) (residue 500 and name HAD*) 5.0 1.5 0.5
assign (residue  4 and name HE*) (residue 500 and name HMD*) 5.0 3.0 0.5
assign (residue  4 and name HE*) (residue 500 and name HD) 5.00 3.4 0.5
assign (residue  5 and name HG1*) (residue 500 and name HMD*) 5.50 1.90 0.5
assign (residue  5 and name HG1*) (residue 500 and name HD) 6.00 1.90 1.0
assign (residue 78 and name HD1*) (residue 500 and name HD) 5.0 3.90 0.5
assign (residue 78 and name HD1*) (residue 500 and name HC) 5.5 2.50 0.00
assign (residue 78 and name HD1*) (residue 500 and name HMC2) 4.35 2.55 0.5
assign (residue 78 and name HD1*) (residue 500 and name HAC) 4.89 3.29 0.0
assign (residue 78 and name HD2*) (residue 500 and name HD) 4.89 3.29 0.0
assign (residue 78 and name HD2*) (residue 500 and name HBC1) 4.89 2.79 0.5
assign (residue 78 and name HD2*) (residue 500 and name HBC2) 4.60 2.50 0.5
assign (residue 78 and name HD2*) (residue 500 and name HMD*) 5.50 2.50 0.5
assign (residue 78 and name HD2*) (residue 500 and name HAC) 5.0 3.9 0.5
assign (residue 78 and name HD2*) (residue 500 and name HMC2) 5.33 3.73 0.0
assign (residue 79 and name HA) (residue 500 and name HMC*) 5.5 3.0 0.0
assign (residue 79 and name HD1*) (residue 500 and name HC) 6.0 2.5 0.0
assign (residue 79 and name HD1*) (residue 500 and name HMC*) 3.8 2.2 0.0
assign (residue 79 and name HG1*) (residue 500 and name HMC*) 5.0 3.4 0.0
assign (residue 82 and name HB*) (residue 500 and name HBC1) 5.5 3.9 0.0
assign (residue 82 and name HB*) (residue 500 and name HBC2) 5.5 3.9 0.0
assign (residue 85 and name HB) (residue 500 and name HBC1) 5.50 1.9 0.5
assign (residue 85 and name HD1*) (residue 500 and name HBC2) 4.35 2.75 0.0
assign (residue 85 and name HG2*) (residue 500 and name HBC1) 5.49 3.89 0.0
assign (residue 85 and name HG2*) (residue 500 and name HMC*) 5.0 3.9 0.0
assign (residue 85 and name HG2*) (residue 500 and name HAC) 5.5 1.9 0.5
assign (residue 95 and name HD*) (residue 500 and name HC) 4.47 2.87 0.0
assign (residue 95 and name HD*) (residue 500 and name HAB) 3.85 2.25 0.0
assign (residue 95 and name HD1*) (residue 500 and name HMC*) 5.0 3.9 0.0
assign (residue 95 and name HD*) (residue 500 and name HBB1) 4.92 3.32 0.0
assign (residue 95 and name HD*) (residue 500 and name HBB2) 3.68 2.08 0.0
assign (residue 95 and name HD2*) (residue 500 and name HC) 4.85 2.05 0.0
assign (residue 99 and name HD1*) (residue 500 and name HMB*) 5.0 1.9 0.5
assign (residue 99 and name HG1*) (residue 500 and name HAB) 4.470 1.9 0.0
assign (residue 99 and name HG2*) (residue 500 and name HAB) 5.03 3.43 0.0
assign (residue 99 and name HG11) (residue 500 and name HC) 5.0 1.5 0.5
assign (residue 99 and name HD1*) (residue 500 and name HBB1) 5.22 3.62 0.0
assign (residue 99 and name HD1*) (residue 500 and name HBB2) 4.67 3.07 0.0
assign (residue 99 and name HD1*) (residue 500 and name HAB) 4.2 1.9 0.5
assign (residue 99 and name HG2*) (residue 500 and name HMB*) 4.74 1.5 0.5
assign (residue 99 and name HG2*) (residue 500 and name HC) 5.0 1.9 0.5
assign (residue 99 and name HD1*) (residue 500 and name HC) 5.0 3.4 0.0
assign (residue 99 and name HD1*) (residue 500 and name HB) 6.0 4.4 1.0
assign (residue 103 and name HG2*) (residue 500 and name HMC3) 3.70 2.1 0.0
assign (residue 103 and name HG2*) (residue 500 and name HMC1) 3.20 1.2 0.0
assign (residue 103 and name HG2*) (residue 500 and name HBC1) 4.87 3.27 0.0
assign (residue 103 and name HG2*) (residue 500 and name HBC2) 4.87 3.27 0.0
assign (residue 103 and name HG2*) (residue 500 and name HAC) 5.0 3.4 0.0
assign (residue 103 and name HG2*) (residue 500 and name HC) 3.86 2.26 0.0
assign (residue 103 and name HG2*) (residue 500 and name HD) 5.5 3.9 0.0
assign (residue 103 and name HD1*) (residue 500 and name HMC3) 4.70 3.1 0.0
assign (residue 103 and name HD1*) (residue 500 and name HAB) 5.0 3.4 0.0
assign (residue 103 and name HG2*) (residue 500 and name HAB) 5.0 3.4 0.0
assign (residue 103 and name HG12) (residue 500 and name HMC*) 4.47 2.87 0.0
assign (residue 103 and name HD1*) (residue 500 and name HC) 4.90 3.3 0.8
assign (residue 104 and name NE2)  (residue 500 and name FE) 2.1 0.10 0.0
assign (residue 104 and name NE2)  (residue 500 and name NA) 3.0 0.10 0.0
assign (residue 104 and name NE2)  (residue 500 and name NB) 3.0 0.10 0.0
assign (residue 104 and name NE2)  (residue 500 and name NC) 3.0 0.10 0.0
assign (residue 104 and name NE2)  (residue 500 and name ND) 3.0 0.10 0.0
assign (residue 107 and name HG2*) (residue 500 and name HMD*) 4.88 2.64 0.0
assign (residue 107 and name HG1*) (residue 500 and name HMD*) 4.38 2.64 0.0
assign (residue 107 and name HG1*) (residue 500 and name HD) 3.5 2.0 0.0
assign (residue 107 and name HG2*) (residue 500 and name HD) 4.0 2.0 0.5
assign (residue 107 and name HG1*) (residue 500 and name HAC) 4.47 2.87 0.0
assign (residue 107 and name HG2*) (residue 500 and name HAC) 4.90 3.3 0.0
assign (residue 107 and name HG1*) (residue 500 and name HBC1) 5.3 3.7 0.0
assign (residue 107 and name HG2*) (residue 500 and name HBC1) 6.0 4.4 0.0
assign (residue 107 and name HB) (residue 500 and name HMD*) 4.38 2.64 0.0
assign (residue 114 and name HB*) (residue 500 and name HMD*) 3.38 1.90 0.0
assign (residue 114 and name HB*) (residue 500 and name HD) 5.5 3.0 0.0
assign (residue 116 and name HD1*) (residue 500 and name HD) 5.5 1.9 0.5
assign (residue 116 and name HD1*) (residue 500 and name HMD*) 4.47 2.87 0.5
assign (residue 116 and name HG) (residue 500 and name HA) 6.2 1.3 0.5
assign (residue 116 and name HD2*) (residue 500 and name HBD*) 5.00 2.60 0.5
assign (residue 131 and name HD1*) (residue 500 and name HMB*) 5.5 3.9 0.5
assign (residue 133 and name HH) (residue 500 and name O1A) 5.0 1.9 0.5
assign (residue 133 and name HH) (residue 500 and name O2A) 5.0 1.9 0.5
assign (residue 135 and name HG) (residue 500 and name O1A) 5.0 1.8 0.5
assign (residue 135 and name HG) (residue 500 and name O2A) 5.0 1.8 0.5
assign (residue 137 and name HE) (residue 500 and name O2A) 5.0 1.8 0.5
assign (residue 137 and name HE) (residue 500 and name O1A) 5.0 1.8 0.5
assign (residue 137 and name HH2*) (residue 500 and name O2D) 5.5 1.5 0.5
assign (residue 137 and name HH2*) (residue 500 and name O1A) 5.0 1.9 0.5
assign (residue 137 and name HH2*) (residue 500 and name O2A) 5.0 1.9 0.5 
assign (residue 142 and name HB*) (residue 500 and name HMA*) 4.67 2.00 0.5
assign (residue 143 and name HA) (residue 500 and name HB) 4.67 2.00 0.5
assign (residue 143 and name HA) (residue 500 and name HMB*) 5.0 3.5 0.5
assign (residue 143 and name HB*) (residue 500 and name HMA*) 4.47 2.0 0.5
assign (residue 143 and name HB*) (residue 500 and name HMB*) 4.7 3.5 0.2
assign (residue 143 and name HB*) (residue 500 and name HB) 4.47 2.5 0.5
assign (residue 146 and name HD1*) (residue 500 and name HMB*) 5.0 3.4 0.5
assign (residue 146 and name HD1*) (residue 500 and name HBB1) 5.5 3.9 0.0
assign (residue 146 and name HD2*) (residue 500 and name HBB1) 6.0 2.55 0.0
assign (residue 146 and name HD1*) (residue 500 and name HBB2) 6.0 2.55 0.0
assign (residue 146 and name HD2*) (residue 500 and name HMB*) 5.0 2.2 0.5
assign (residue 146 and name HD2*) (residue 500 and name HB) 5.5 1.5 0.5
assign (residue 146 and name HD2*) (residue 500 and name HC) 3.5 1.5 0.5
assign (residue 146 and name HD1*) (residue 500 and name HMA*) 5.5 3.5 0.5
assign (residue 146 and name HD1*) (residue 500 and name HB) 4.2 1.5 0.5
assign (residue 146 and name HB2*) (residue 500 and name HMB*) 4.2 1.5 0.5
assign (residue 147 and name HD2*) (residue 500 and name HMB*) 4.6 2.64 0.0
assign (residue 147 and name HD2*) (residue 500 and name HBB2) 4.2 2.22 0.0
assign (residue 147 and name HD2*) (residue 500 and name HBB1) 4.24 2.64 0.0
assign (residue 147 and name HA) (residue 500 and name HAB) 5.11 3.51 0.5
assign (residue 147 and name HN) (residue 500 and name HMB3) 5.00 2.26 0.0
assign (residue 150 and name HB*) (residue 500 and name HBB*) 4.76 2.56 0.5
assign (residue 150 and name HB*) (residue 500 and name HBB2) 4.76 2.56 0.5
assign (residue 150 and name HB*) (residue 500 and name HAB) 5.0 2.5 0.5# Restraints file 3: hbda.tbl
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image	mrblock_id	pdb_id	bmrb_id	cing	stage	position	program	type	subtype	subsubtype
	650225	6wqe	27284	cing	1-original	2	XPLOR/CNS	distance	NOE	simple