Dihydrofolate reductase 3D structures

1ohk, 1ohj, 5dxv – hDHFR – different crystal forms - human

3f8y, 3f8z, 3f91, 3eig, 1dlr, 1dls – hDHFR (mutant)

3ia5 – MpDHFR – Mritella profunda

2kgk, 2qk8, 8ssx – BaDHFR – Bacillus anthracis

3dfr – LcDHFR – Lactobacillus casei

2w9t – SaDHFR S1 - Staphylococcus aureus

2ith, 1vdr – HvDHFR - Haloferax volcanii

2rh2, 2gqv, 1vie, 1vif, 5dfr, 4p3q, 4p3r, 5z6f, 5z6j, 5z6k, 5z6l, 5z6m – EcDHFR – Escherichia coli

1dhi, 1dhj, 2d0k, 4p66, 4p68, 5ujx – EcDHFR (mutant)

3sfm – EcDHFR-2

1dyr – PncDHFR - Pneumocystis carinii

1zdr – BsDHFR – Bacillus stearothermophilus

1juv – DHFR – Bacteriophage T4

1ai9 – CaDHFR - Candida albicans

1cz3, 1d1g – DHFR – Thermotoga maritima

3q1h, 5fda, 8szd – YpDHFR – Yersinia pestis

2l28 – DHFR – Lactobacillus casei - NMR

3vco – DHFR – Schistosoma mansoni

8f09 – DHFR – uncultured bacteria

7rzo – SmDHFR – Stenotrophomonas maltophila

7zzx – CaDHFR - Candidozyma auris

6pfi - hDHFR-TS + NADPH + dUMP + pyrimidine derivative

8dae - DHFR-TS – Arabidopsis thaliana

3cl9, 2h2q, 3qfx – TcDHFR-TS - Trypanosoma cruzi

1qzf - ChTcDHFR-TS – Cryptosporidium hominis

3dl5, 3dl6, 2oip – ChDHFR-TS (mutant)

3i3r, 3kjr - BbDHFR-TS – Babesia bovis

3clb – TcDHFR-TS + TMX

3irm, 3iro - TcDHFR-TS + inhibitor

3irn - TcDHFR-TS+NADPH +inhibitor

3inv - TcDHFR-TS+NADPH+dUMP+inhibitor

5t7o - TcDHFR-TS+NADPH+dUMP + folate derivative

3kjs, 3rg9 - TcDHFR-TS+NADPH +inhibitor

3hbb – TcDHFR-TS+MTX & TMTX

3dg8, 1j3i, 3dga, 3qgt, 6a2k, 6a2m, 6a2o, 7ctz, 7f3y, 7f3z - PfDHFR-TS+NADPH +dUMP+inhibitor – Plasmodium falciparum

1j3k, 1j3j, 3jsu, 6a2l, 6a2n, 6a2p, 8jfb, 8jfc, 8wgm, 8wgn, 8yq8, 8yq9 - PfDHFR-TS (mutant)+NADPH+dUMP+ inhibitor

7ctw, 7cty - PfDHFR-TS +NADPH+ inhibitor

3qg2, 6leu, 6lev, 6lez, 6lh9, 6lhi, 6lhj, 8jfd - PfDHFR-TS (mutant)+NADPH + inhibitor

3um8, 4dph, 6kot - PfDHFR-TS + NADPH + anti-malarial drug

3um5, 3um6, 4dp3, 6kp2, 6kp7, 6kpr - PfDHFR-TS (mutant)+NADPH + dUMP + anti-malarial drug

4dpd - PfDHFR-TS +NADPH + dUMP + folate

3k2h, 3nrr - BbDHFR-TS+NADPH+dUMP+inhibitor

2bl9, 2bla, 2blb, 2blc – PvDHFR-TS+ anti-malarial drug – Plasmodium vivax

4eck, 4eil - TgDHFR-TS + NADPH + dUMP + folate – Toxoplasma gondii

4ky4, 4kya - TgDHFR-TS + NADPH + dUMP + aminopterin

5t0l, 6n1t - TgDHFR-TS + NADPH + dUMP + folate derivative + inhibitor

7fgw, 7fgx, 7fgy - TgDHFR-TS + NADPH + dUMP + inhibitor

3hj3 - ChDHFR-TS + NADPH + dUMP + MTX

4ky8, 4q0d, 4q0e, 6ojs, 6pf7, 6pf8, 6pf9, 6pfa, 6pfb, 6pfc, 6pfd, 6pfe, 6pff, 6pfg, 6pfh, 6pfi - ChDHFR-TS + NADPH + dUMP + MTX + pyrimidine derivative

6aog, 6aoh, 6aoi - TgDHFR-TS + NADPH + dUMP + folate derivative + inhibitor

6n1s - TgDHFR-TS (mutant) + NADPH + dUMP + folate derivative + inhibitor

1e26 - PcDHFR-TS+NADP+folate - Plasmodium carinii

1qzf - ChTcDHFR-TS – Cryptosporidium hominis

3dl5, 3dl6, 2oip – ChDHFR-TS (mutant)

3hj3 - ChDHFR-TS + NADPH + dUMP + MTX

4ky8, 4q0d, 4q0e - ChDHFR-TS + NADPH + dUMP + MTX + pyrimidine derivative

3i3r, 3kjr - BbDHFR-TS – Babesia bovis

3k2h, 3nrr - BbDHFR-TS+NADPH+dUMP+inhibitor

1s3u, 1s3v, 1s3w – hDHFR+tetrahydroauinazoline

1mvs, 1mvt, 1pd8, 1pd9, 1pdb, 1mvs, 1mvt, 3fs6, 1hfp, 1hfq, 1hfr, 2c2s, 2c2t, 2w3b, 3gyf, 3nxo, 3nxr, 3nxt, 3nxv, 3nu0, 4g95, 7xi7 – hDHFR+pyrimidine derivatives

3s7a - hDHFR+ inhibitor

3l3r, 3gi2, 3ghc, 3ghv, 3ghw, 3oaf – hDHFR (mutant)+pyrimidine derivatives

3n0h, 3s3v – hDHFR (mutant) +TMP

3fra – SaDHFR (mutant)+iclaprim

3sqy, 3sr5, 3srq, 3srr, 3srs, 3sru, 3srw, 4fgg, 4fgh – SaDHFR + inhibitor

2w9h – SaDHFR+TMP

3fl8 – BaDHFR+RAB1

3fl9 – BaDHFR+TMP

4elb, 4ele, 4elf, 4elg, 4elh – BaDHFR + inhibitor

2hm9 – LcDHFR+TMP

1ao8 - LcDHFR+MTX – NMR

1dis, 1diu - LcDHFR+ brodimoprim – NMR

1dra, 1drb, 2drc, 3drc, 1dds, 4dfr - EcDHFR+MTX

2inq – EcDHFR+MTX – neutron diffraction

1rx5, 3och, 6cqa, 6nxz, 6ny0, 7f3b, 7mqp, 7reb - EcDHFR+ inhibitor

7nae – EcDHFR + TMP

9daq, 9dar – EcDHFR + cycloguanil

9cum – EcDHFR (mutant) + congo red

4eig, 4eiz – EcDHFR + antibody fragment

2cig – MtDHFR+isoniazid derivative – Mycobacterium tuberculosis

4klx - MtDHFR + ADP

6vs5 - MtDHFR + pyrazole derivative

8cop, 8cow, 8cox – MtDHFR+pyrimidine derivative

3tq8 - CbDHFR + TMP – Coxiella burnetii

3tq9 – CbDHFR + MTX

4qi9, 5hi6 - YpDHFR + MTX

8sze - YpDHFR + TMP

7myl - KpDHFR + TMP

7l9t - MsDHFR + pyrimidine derivative – Mycobacterium smegmatis

4ddr, 4kak, 4kbn, 4kd7, 4keb, 4kfj, 4qhv, 4qjc, 5hpb, 5hqy, 5hqz, 5hsr, 5hsu, 5ht4, 5ht5, 5hui, 5hvb, 5hve, 1kms, 1kmv, 3ntz, 3nxx, 3nxy, 6a7c, 6a7e, 6de4, 7reg, 7rgj, 7rgk – hDHFR + NADPH + pyrimidine inhibitor

3sgy, 3sh2, 4tu5, 4xe6, 4xec, 5hf0, 5hf2, 5jg0, 6e4e, 6nd2, 6pbo, 7t7q, 7t7s - SaDHFR +NADP+ pyrimidine derivative

3i8a, 3f0q, 3f0s, 3f0v, 3f0x, 3f0b, 3f0u, 3fq0, 3fqc, 3fqf, 3fqo, 3fqv, 3fqz, 3lg4, 5isp, 5isq, 5ist – SaDHFR (mutant)+NADPH+ pyrimidine derivative

2w3w – MaDHFR+NADPH+ pyrimidine derivative

3e0b, 3jvx, 3jwc, 3jwf, 3jwk, 3jwm – BaDHFR (mutant)+NADP+ pyrimidine derivative

3cse, 3eej, 3eek, 3eel, 3eem, 4h98, 4hog, 3qlx - CgDHFR +NADPH+ pyrimidine derivatives – Candida glabrata

1daj, 3nz6, 3nz9, 3nzb, 3nzc, 3nzd, 4ixe, 4qjz – PcDHFR + NADPH + pyrimidine derivative

4ixf, 4ixg – PcDHFR (mutant) + NADPH + pyrimidine derivative

1ly4, 3td8 - PcDHFR +NAP+pyrimidine derivative

4h95, 4h96, 4h97, 4hoe, 4hof - CaDHFR + NADPH + pyrimidine derivative

4km0 – MtDHFR + ADP + pyrimidine derivative

5ja3, 5scd, 5scm, 5scn, 5sco, 5scp, 5scq, 5scr, 5sct, 5scu, 5scv, 5scw, 5scx, 5scy, 5scz, 5sd0, 5sd1, 5sd2, 5sd3, 5sd4, 5sd5, 5sd6, 5sd7, 5sd8, 5sd9, 5sda, 5sdb]], 5u26, 5u27, 5ujf, 6ddp, 6dds, 6ddw, 6nnc, 6nne, 8coq – MtDHFR + NADP + pyrimidine derivative

3nza - PncDHFR+NADPH+ pyrimidine derivative

4m7v - EfDHFR +NADPH + pyrimidine derivative - Enterococcus faecalis

4or7, 4osg, 5ecc, 5ecx - DHFR +NADPH + pyrimidine derivative – Klebsiella pneumoniae

6cxm - MsDHFR +NADPH + pyrimidine derivative – Mycobacterium smegmatis

7k6c – DHFR (mutant) + NADPH + pyrimidine derivative – Mycobacterioides abscessus

6uwq, 6uww, 7k69, 7k6a, 7kac, 7ki8, 7ki9, 7km7, 7km8, 7ka9, 8cq8, 8cq9, 8cqa – MuDHFR + NADPH + pyrimidine derivative – Mycobacterium ulcerans

7k68, 7k6a, 8f80, 8f81, 8f82, 8f83, 8f84, 8f85, 8ta0, 8ta1, 8tbr – MuDHFR (mutant) + NADPH + pyrimidine derivative

7rgo – EcDHFR + NADPH + pyrimidine derivative

7tj3 – SmDHFR + NADPH + pyrimidine derivative

8a0z – CaDHFR + NADPH + pyrimidine derivative

8crh – CaDHFR + NADPH + cycloguanil

1boz – hDHFR (mutant)+NADPH+quinazoline derivative

4lae, 4lag, 4lah, 4lek - SaDHFR +NADPH+ quinazoline derivative

3qyl, 3qyo, 3r33, 3kfy - EcDHFR +NADPH+quinazoline derivative

1ly3, 1s3y – PcDHFR +NAP+quinazoline derivative

1m79, 1m78, 1m7a, 1ia1, 1ia2, 1ia3, 1ia4, 1aoe – CaDHFR+NADPH+quinazoline derivative

1sej - ChDHFR +NADPH+quinazoline derivative+deoxyuridine

6dtc – DHFR +NADPH+quinazoline derivative – Aspergillus flavus

2w3a – hDHFR +TMP+NADPH

1yho - hDHFR+NADPH+ TMP – NMR

2fzi, 2fzj - mDHFR+NADPH+ TMP

2w9g - SaDHFR+ TMP +NADPH

3fre, 2w9s, 3frb – SaDHFR (mutant)+TMP+NADPH

4g8z - DHFR (mutant)+TMP+NADPH – Pneumocystis jirovecii

2w3v, 8vtc – MaDHFR +TMP+NADPH – Mycobacterium avium

3jw3, 3jw5 – BaDHFR (mutant)+ TMP +NADPH

3s9u, 3sa1, 3sa2, 3sai – BaDHFR (mutant) +TMP analog + NADP

1lud - LcDHFR+NADPH+ TMP – NMR

2fzh – PcDHFR+NADPH+ TMP

1dg5 - MtDHFR + TMP +NADPH

4km2 - MtDHFR + ADP + TMP

6xg4, 6xg5, 7mym, 7r6g, 9kz4 - EcDHFR+NADPH+ TMP

1u71, 1u72 - hDHFR (mutant)+MTX+NADPH

1u70 – mDHFR (mutant)+MTX+NADPH

3ia4 – MpDHFR+ MTX +NADPH

3dat - BaDHFR+ MTX+NADPH

1bzf - LcDHFR+NADPH+ TMX – NMR

1dre, 1rb3, 1rg7, 1rh3, 1ra3, 1rx3, 3dau, 4gh8 - EcDHFR+NADP+MTX

1ddr - EcDHFR+MTX+urea

1tdr - EcDHFR+MTX+Te

6p9z, 6wep - SaDHFR +MTX+NADPH

1df7 - MtDHFR +MTX+NADPH

3ix9 – DHFR (mutant) +MTX+NADPH – Streptococcus pneumoniae

3k45, 3k47 – mDHFR+E & Z-isomer+NADPH – mouse

3d80, 3d84 – mDHFR+NADPH+ pteridin derivative

1klk – DHFR+NADPH+PT653 – rat

1dr1, 1dr2, 1dr3 - cDHFR+NADP+biopterin – chicken

1dr4, 1dr5, 1dr6, 1dr7 - cDHFR+NADP+biopterin+Hg

3m08 - SaDHFR+RAB1+NADP

3m09 – SaDHFR (mutant)+RAB1+NADP

3fy8, 3fyw – SaDHFR + AR-101+NADPH

3fy9 – SaDHFR (mutant)+ AR-102+NADPH

3fyv – SaDHFR (mutant)+ AR-102+NADPH

3fyw – SaDHFR + AR-101+NADPH

3frf – SaDHFR (mutant)+iclaprim+NADPH

6pr6, 6pr7, 6pr8, 6pr9, 6prb, 6prd – SaDHFR + phthalazine derivative +NADPH

2ano, 2anq - EcDHFR+NADPH+MS-SH08-17

5uih - EcDHFR+NADP + drug

5uii – EcDHFR (mutant) + NADP + drug

1vj3 – PcHDFR+TAB+NADPH

4m2x - MtDHFR + trimetrexate +NADPH

6nnh - MtDHFR + cycloguanyl +NADPH

6nni - MtDHFR + pyrimethamine +NADPH

4kne - MtDHFR + ADP + anti-folate drug

1dg7 - MtDHFR + 4-Br-WR99210 +NADPH

6vs6, 6vs8, 6vs9, 6vsb, 6vsd, 6vse, 6vsf, 6vsg, 6vv6, 6vv7, 6vv9, 6vvb - MtDHFR + inhibitor +NADPH

8rht - DHFR + inhibitor + NADPH – Trypanosoma brucei

5uio - EcDHFR + pyrimidine diamine +NADPH + monophosphateadenosine diphosphoribose + aminobenzyl carbonyl glutamate

5uip - EcDHFR (mutant) + pyrimidine diamine +NADPH + monophosphateadenosine diphosphoribose + aminobenzyl carbonyl glutamate

8v9r, 9c87 - EcDHFR + ClpXP + ADP + ATP + MTX – Cryo EM

2w3m, 4m6k, 6dav, 7ese – hDHFR +folate+NADPH

1drf - hDHFR +folate

1dhf, 2dhf – hDHFR+folate+5-deazofolate

4m6l - hDHFR+folate+ NADPH + folate derivative

6vcj - hDHFR+folate+ NADPH + pyrimidine derivative + drug

1e26 - PcDHFR-TS+NADP+folate

2jyb – HvDHFR+folate

8e4f - DHFR+folate+ NADPH – Wuhereria bancrofti

8ucx – EcDHFR + folate

2rk1 – EcDHFR+NADP+dihydrofolate

7dfr - EcDHFR+NAP+NADP+folate

1ra8, 1rx8, 1rx4 – EcDHFR+folate+ ADP derivative

1dyl, 1rb2, 1rx2, 1ra2, 3ql3, 4kjj, 4kjk, 4nx6, 4nx7, 4pss, 4pst, 4psy, 4pth, 4ptj, 4rgc, 4x5f, 4x5g, 4x5h, 4x5i, 4x5j, 5sss, 5sst, 5ssu, 5ssv, [[[5ssw]], [7d3z]], 7d49, 7d4l, 7d4x, 7d6g, 7fpl, 7fpm, 7fpn, 7fpo, 7fpp, 7fpq, 7fpr, 7fps, 7fpt, 7fpu, 7fpv, 7fpw, 7fpx, 7fpy, 7fpz, 7fq0, 7fq1, 7fq2, 7fq3, 7fq4, 7fq5, 7fq6, 7fq7, 7fq8, 7fq9, 7fqa, 7fqb, 7fqc, 7fqd, 7fqe, 7fqf, 7fqg, 7lvc, 8g50, 8uw0 - EcDHFR+folate+NADP

4pdj - EcDHFR+folate+NADP – Neutron

8g4z - EcDHFR+folate+NADP – Laue

1dyh, 1dyj, 1rc4, 1rx6, 5cc9, 5ccc, 6cyv, 8dai - EcDHFR+folate derivative +NADP

3ql0, 4kjl, 4qle, 4qlf, 4qlg – EcDHFR (mutant) +folate+NADP

1rx7, 1rd7, 1re7, 5e8q, 5eaj,1dyi, 1rf7, 6cw7, 6cxk, 1jol, 1jom, 6mr9 - EcDHFR+folate derivative

1drh, 6mt8, 6mth - EcDHFR+ folate+folate derivative

4ej1, 4fhb – EcDHFR + antibody fragment + folate

3jtw – DHFR + ligand – Pediococcus pentosaceus

2cd2, 3cd2, 4cd2 - PcDHFR+NADP+folate

1cd2 - PcHDFR+folate+NADPH

2zza – MpDHFR+ folate +NADP

8uvz - DHFR+ folate +NADP – Bacillus subtilis

3tqb – CbDHFR + NADPH + folate

3frd – SaDHFR (mutant)+folate +NADP

6nnd - MtDHFR + DHF +NADPH

4m6j - hDHFR +NADPH

8dfr - cDHFR +NADPH

2hqp, 2lf1 – LcDHFR+NADPH – NMR

2rk2, 2p4t, 1ra9, 1rx9 – EcDHFR+NADP

1rx1, 1ra1 - EcDHFR+NADPH

5w3q, 8vz4 - EcDHFR (mutant) +NADPH

6dfr - EcDHFR+NAP+NADP

1dg8, 4kl9 - MtDHFR +NADPH

3tqa – CbDHFR + NADPH

2xw7 - DHFR +NADPH – Mycobacterium smegmatis

4m7u - EfDHFR +NADPH

4q67, 6pra - SaDHFR +NADPH

4q6a - SaDHFR (mutant) +NADPH

8a0n – CaDHFR + NADPH

3k74, 4i13, 4i1n – EcDHFR+nanobody