G61324ZT
has sequence: WURCS=2.0/5,10,9/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5][a1221m-1a_1-5]/1-1-2-3-1-4-3-3-3-5/a3-b1_a6-j1_b4-c1_c3-d1_c6-g1_d2-e1_e4-f1_g2-h1_g6-i1
in carbohydrate format: carbohydrate format wurcs
sdf: md.pdb OpenBabel05162411523D 230239 0 0 1 0 0 0 0 0999 V2000 11.3000 15.4200 21.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1800 14.7100 20.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3400 14.1600 19.9600 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2200 13.5700 19.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8200 13.1600 20.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1100 12.5400 20.6300 C 0 0 2 0 0 0 0 0 0 0 0 0 14.0300 12.0600 19.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4000 11.6000 21.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2900 11.0300 21.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6300 10.8900 22.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8600 12.2700 23.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2100 13.5700 20.3600 C 0 0 1 0 0 0 0 0 0 0 0 0 15.7200 13.8400 21.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2400 12.8600 19.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8800 13.5100 19.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7500 14.6600 19.3800 C 0 0 1 0 0 0 0 0 0 0 0 0 14.6700 14.2700 18.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3800 15.2800 19.7900 C 0 0 1 0 0 0 0 0 0 0 0 0 13.5400 15.7300 20.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9200 16.1900 18.7200 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0000 15.8600 17.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5900 17.4900 18.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4600 18.0100 20.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3600 18.4300 17.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3100 18.6400 17.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6500 17.9400 17.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9900 19.4000 18.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8100 15.6300 19.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6500 15.6400 18.1400 C 0 0 2 0 0 0 0 0 0 0 0 0 16.0200 15.4500 17.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6800 14.6300 18.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2400 14.3700 16.8200 C 0 0 2 0 0 0 0 0 0 0 0 0 17.3400 14.1900 16.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2200 13.2000 16.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0200 13.4000 17.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6900 13.0600 15.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4900 12.0100 17.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6100 11.9400 17.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9300 15.6900 16.4000 C 0 0 2 0 0 0 0[cell cut: 15731 characters, first 2000 kept]
cif: data_MD_SNFG # _pdbx_database_status.entry_id MD_SNFG _pdbx_database_status.status_code . _pdbx_database_status.status_code_sf ? _pdbx_database_status.status_code_mr ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.recvd_initial_deposition_date ? _pdbx_database_status.status_code_nmr_data ? _pdbx_database_status.deposit_site ? _pdbx_database_status.process_site ? _pdbx_database_status.SG_entry ? _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.methods_development_category ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 branched man ;beta-D-galactopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[alpha-D-mannopyranose-(1-2)-[alpha-D-mannopyranose-(1-6)]alpha-D-mannopyranose-(1-6)]alpha-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-3)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose ; 1746.579 1 ? ? ? ? 2 non-polymer syn ? ? 1 ? ? ? ? # _pdbx_nonpoly_scheme.asym_id B _pdbx_nonpoly_scheme.entity_id 2 _pdbx_nonpoly_scheme.mon_id ROH _pdbx_nonpoly_scheme.ndb_seq_num 1 _pdbx_nonpoly_scheme.pdb_seq_num 1 _pdbx_nonpoly_scheme.auth_seq_num 1 _pdbx_nonpoly_scheme.pdb_mon_id ROH _pdbx_nonpoly_scheme.auth_mon_id ROH _pdbx_nonpoly_scheme.pdb_strand_id ? _pdbx_nonpoly_scheme.pdb_ins_code . # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight FUC "L-saccharide, alpha linking" . alpha-L-fucopyranose "alpha-L-fucose; 6-deoxy-alpha-L-galactopyranose; L-fucose; fucose" "C6 H12 O5" 164.156 GAL "D-saccharide, beta linking" . beta-D-galactopyranose "beta-D-galactose; D-galactose; galactose" "C6 H12 O6" 180.156 MAN "D-saccharide, alpha linking" . alpha-D-mannopyranose "alpha-D-mannose; D-mannose; mannose" "C6 H12 O6" 180.[cell cut: 28501 characters, first 2000 kept]
pdb: LINK O1 ROH A 1 C1 VYB A 2 1.43 LINK O6 VYB A 2 C1 0fA A 11 1.46 LINK O3 VYB A 2 C1 4YB A 3 1.46 LINK O4 4YB A 3 C1 VMB A 4 1.46 LINK O6 VMB A 4 C1 XMA A 8 1.46 LINK O3 VMB A 4 C1 2MA A 5 1.46 LINK O2 2MA A 5 C1 4YB A 6 1.46 LINK O4 4YB A 6 C1 0LB A 7 1.46 LINK O6 XMA A 8 C1 0MA A 10 1.46 LINK O2 XMA A 8 C1 0MA A 9 1.46 ATOM 1 HO1 ROH 1 11.300 15.420 21.020 1.00 0.00 H ATOM 2 O1 ROH 1 11.180 14.710 20.390 1.00 0.00 O ATOM 3 C1 NAG 2 12.340 14.160 19.960 1.00 0.00 C ATOM 4 H1 NAG 2 12.220 13.570 19.050 1.00 0.00 H ATOM 5 O5 NAG 2 12.820 13.160 20.970 1.00 0.00 O ATOM 6 C5 NAG 2 14.110 12.540 20.630 1.00 0.00 C ATOM 7 H5 NAG 2 14.030 12.060 19.660 1.00 0.00 H ATOM 8 C6 NAG 2 14.400 11.600 21.780 1.00 0.00 C ATOM 9 H62 NAG 2 15.290 11.030 21.530 1.00 0.00 H ATOM 10 H61 NAG 2 13.630 10.890 22.070 1.00 0.00 H ATOM 11 O6 NAG 2 14.860 12.270 23.010 1.00 0.00 O ATOM 12 C4 NAG 2 15.210 13.570 20.360 1.00 0.00 C ATOM 13 H4 NAG 2 15.720 13.840 21.290 1.00 0.00 H ATOM 14 O4 NAG 2 16.240 12.860 19.630 1.00 0.00 O ATOM 15 H4O NAG 2 16.880 13.510 19.320 1.00 0.00 H ATOM 16 C3 NAG 2 14.750 14.660 19.380 1.00 0.00 C ATOM 17 H3 NAG 2 14.670 14.270 18.370 1.00 0.00 H ATOM 18 C2 NAG 2 13.380 15.280 19.790 1.00 0.00 C ATOM 19 H2 NAG 2 13.540 15.730 20.770 1.00 0.00 H ATOM 20 N2 NAG 2 12.920 16.190 18.720 1.00 0.00 N ATOM 21 H2N NAG 2 13.000 15.860 17.770 1.00 0.00 H ATOM 22 C2N NAG 2 12.590 17.490 18.930 1.00 0.00 C ATOM 23 O2N NAG 2 12.460 18.010 20.060 1.00 0.00 O ATOM 24 CME NAG 2 12.360 18.430 17.670 1.00 0.00 C ATOM 25 H3M NAG 2 13.310 18.640 17.170 1.00 0.00 H ATOM 26 H2M NAG 2 11.650 17.940 17.000 1.00 0.00 H ATOM 27 H1M NAG 2 11.990 19.400 18.000 1.00 0.00 H ATOM 28 O3 NAG 2 15.810 15.630 19.340 1.00 0.00 O ATOM 29 C1 NAG 3 16.650 15.640 18.140 1.00 0.00 C ATOM 30 H1 NAG 3 16.020 15.450 17.270 1.00 0.00 H ATOM 31 O5 NAG 3 17.680 14.630 18.140 1.00 0.00 O ATOM 32 C5 NAG 3 18.240 14.370 16.820 1.00 0.00 C ATOM 33 H5 NAG 3 17.340 14.190 16.220 1.00 0.00 H ATOM 34 C6 NAG 3 19.220 13[cell cut: 16112 characters, first 2000 kept]